methyl (2S)-2-[[4-[di(propan-2-yl)carbamoyl]-2-phenoxy-phenyl]carbonylamino]-4-methyl-pentanoate

Systemtic Name: methyl (2S)-2-[[4-[di(propan-2-yl)carbamoyl]-2-phenoxy-phenyl]carbonylamino]-4-methyl-pentanoate Openeye Name: methyl (2S)-2-[[4-(diisopropylcarbamoyl)-2-phenoxy-benzoyl]amino]-4-methyl-pentanoate CAS Name: (2S)-2-[[[4-[[di(propan-2-yl)amino]-oxomethyl]-2-phenoxyphenyl]-oxomethyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[4-[di(propan-2-yl)carbamoyl]-2-phenoxybenzoyl]amino]-4-methylpentanoate Traditional Name: (2S)-2-[[4-(diisopropylcarbamoyl)-2-phenoxy-benzoyl]amino]-4-methyl-valeric acid methyl ester Formula: C27H36N2O5 MolecularWeight: 468.58514

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC(=O)C1=C(C=C(C=C1)C(=O)N(C(C)C)C(C)C)OC2=CC=CC=C2

Isomeric SMILES

CC(C)C[C@@H](C(=O)OC)NC(=O)C1=C(C=C(C=C1)C(=O)N(C(C)C)C(C)C)OC2=CC=CC=C2

InChI

InChI=1S/C27H36N2O5/c1-17(2)15-23(27(32)33-7)28-25(30)22-14-13-20(26(31)29(18(3)4)19(5)6)16-24(22)34-21-11-9-8-10-12-21/h8-14,16-19,23H,15H2,1-7H3,(H,28,30)/t23-/m0/s1