(2S)-2-[[1-[(2S)-2-acetamido-6-azanyl-hexanoyl]-4-phenyl-piperidin-4-yl]carbonylamino]-4-azanyl-4-oxidanylidene-butanoic acid

Systemtic Name: (2S)-2-[[1-[(2S)-2-acetamido-6-azanyl-hexanoyl]-4-phenyl-piperidin-4-yl]carbonylamino]-4-azanyl-4-oxidanylidene-butanoic acid Openeye Name: (2S)-2-[[1-[(2S)-2-acetamido-6-amino-hexanoyl]-4-phenyl-piperidine-4-carbonyl]amino]-4-amino-4-oxo-butanoic acid CAS Name: (2S)-2-[[[1-[(2S)-2-acetamido-6-amino-1-oxohexyl]-4-phenyl-4-piperidinyl]-oxomethyl]amino]-4-amino-4-oxobutanoic acid IUPAC Name: (2S)-2-[[1-[(2S)-2-acetamido-6-aminohexanoyl]-4-phenylpiperidine-4-carbonyl]amino]-4-amino-4-oxobutanoic acid Traditional Name: (2S)-2-[[1-[(2S)-2-acetamido-6-amino-hexanoyl]-4-phenyl-isonipecotoyl]amino]-4-amino-4-keto-butyric acid Formula: C24H35N5O6 MolecularWeight: 489.5646

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CCCCN)C(=O)N1CCC(CC1)(C2=CC=CC=C2)C(=O)NC(CC(=O)N)C(=O)O

Isomeric SMILES

CC(=O)N[C@@H](CCCCN)C(=O)N1CCC(CC1)(C2=CC=CC=C2)C(=O)N[C@@H](CC(=O)N)C(=O)O

InChI

InChI=1S/C24H35N5O6/c1-16(30)27-18(9-5-6-12-25)21(32)29-13-10-24(11-14-29,17-7-3-2-4-8-17)23(35)28-19(22(33)34)15-20(26)31/h2-4,7-8,18-19H,5-6,9-15,25H2,1H3,(H2,26,31)(H,27,30)(H,28,35)(H,33,34)/t18-,19-/m0/s1