2-methoxyethyl 4-[[(2S)-4-azanyl-1-(3-naphthalen-1-ylpropylamino)-1,4-bis(oxidanylidene)butan-2-yl]carbamoyl]-4-[[(2S)-2-[[4-[bis[(2-methylpropan-2-yl)oxy]phosphorylmethyl]phenyl]methyl]-4-[(2-methylpropan-2-yl)oxy]-4-oxidanylidene-butanoyl]amino]piperidine-1-carboxylate

Systemtic Name: 2-methoxyethyl 4-[[(2S)-4-azanyl-1-(3-naphthalen-1-ylpropylamino)-1,4-bis(oxidanylidene)butan-2-yl]carbamoyl]-4-[[(2S)-2-[[4-[bis[(2-methylpropan-2-yl)oxy]phosphorylmethyl]phenyl]methyl]-4-[(2-methylpropan-2-yl)oxy]-4-oxidanylidene-butanoyl]amino]piperidine-1-carboxylate Openeye Name: 2-methoxyethyl 4-[[(1S)-3-amino-1-[3-(1-naphthyl)propylcarbamoyl]-3-oxo-propyl]carbamoyl]-4-[[(2S)-4-tert-butoxy-2-[[4-(ditert-butoxyphosphorylmethyl)phenyl]methyl]-4-oxo-butanoyl]amino]piperidine-1-carboxylate CAS Name: 4-[[[(2S)-4-amino-1-[3-(1-naphthalenyl)propylamino]-1,4-dioxobutan-2-yl]amino]-oxomethyl]-4-[[(2S)-2-[[4-[bis[(2-methylpropan-2-yl)oxy]phosphorylmethyl]phenyl]methyl]-4-[(2-methylpropan-2-yl)oxy]-1,4-dioxobutyl]amino]-1-piperidinecarboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 4-[[(2S)-4-amino-1-(3-naphthalen-1-ylpropylamino)-1,4-dioxobutan-2-yl]carbamoyl]-4-[[(2S)-2-[[4-[bis[(2-methylpropan-2-yl)oxy]phosphorylmethyl]phenyl]methyl]-4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[(1S)-3-amino-3-keto-1-[3-(1-naphthyl)propylcarbamoyl]propyl]carbamoyl]-4-[[(2S)-4-tert-butoxy-2-[4-(ditert-butoxyphosphorylmethyl)benzyl]-4-keto-butanoyl]amino]piperidine-1-carboxylic acid 2-methoxyethyl ester Formula: C51H74N5O12P MolecularWeight: 980.133321

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CC(CC1=CC=C(C=C1)CP(=O)(OC(C)(C)C)OC(C)(C)C)C(=O)NC2(CCN(CC2)C(=O)OCCOC)C(=O)NC(CC(=O)N)C(=O)NCCCC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC(C)(C)OC(=O)C[C@H](CC1=CC=C(C=C1)CP(=O)(OC(C)(C)C)OC(C)(C)C)C(=O)NC2(CCN(CC2)C(=O)OCCOC)C(=O)N[C@@H](CC(=O)N)C(=O)NCCCC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C51H74N5O12P/c1-48(2,3)66-43(58)32-39(31-35-20-22-36(23-21-35)34-69(63,67-49(4,5)6)68-50(7,8)9)44(59)55-51(24-27-56(28-25-51)47(62)65-30-29-64-10)46(61)54-41(33-42(52)57)45(60)53-26-14-18-38-17-13-16-37-15-11-12-19-40(37)38/h11-13,15-17,19-23,39,41H,14,18,24-34H2,1-10H3,(H2,52,57)(H,53,60)(H,54,61)(H,55,59)/t39-,41-/m0/s1