(4S)-5-oxidanylidene-5-(4-pentoxycarbonylpiperazin-1-yl)-4-[(6-phenyl-4-piperidin-4-yloxy-pyridin-2-yl)carbonylamino]pentanoic acid

Systemtic Name: (4S)-5-oxidanylidene-5-(4-pentoxycarbonylpiperazin-1-yl)-4-[(6-phenyl-4-piperidin-4-yloxy-pyridin-2-yl)carbonylamino]pentanoic acid Openeye Name: (4S)-5-oxo-5-(4-pentoxycarbonylpiperazin-1-yl)-4-[[6-phenyl-4-(4-piperidyloxy)pyridine-2-carbonyl]amino]pentanoic acid CAS Name: (4S)-5-oxo-5-[4-[oxo(pentoxy)methyl]-1-piperazinyl]-4-[[oxo-[6-phenyl-4-(4-piperidinyloxy)-2-pyridinyl]methyl]amino]pentanoic acid IUPAC Name: (4S)-5-oxo-5-(4-pentoxycarbonylpiperazin-1-yl)-4-[(6-phenyl-4-piperidin-4-yloxypyridine-2-carbonyl)amino]pentanoic acid Traditional Name: (4S)-5-(4-amoxycarbonylpiperazino)-5-keto-4-[[6-phenyl-4-(4-piperidyloxy)picolinoyl]amino]valeric acid Formula: C32H43N5O7 MolecularWeight: 609.71312

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)N1CCN(CC1)C(=O)C(CCC(=O)O)NC(=O)C2=CC(=CC(=N2)C3=CC=CC=C3)OC4CCNCC4

Isomeric SMILES

CCCCCOC(=O)N1CCN(CC1)C(=O)[C@H](CCC(=O)O)NC(=O)C2=CC(=CC(=N2)C3=CC=CC=C3)OC4CCNCC4

InChI

InChI=1S/C32H43N5O7/c1-2-3-7-20-43-32(42)37-18-16-36(17-19-37)31(41)26(10-11-29(38)39)35-30(40)28-22-25(44-24-12-14-33-15-13-24)21-27(34-28)23-8-5-4-6-9-23/h4-6,8-9,21-22,24,26,33H,2-3,7,10-20H2,1H3,(H,35,40)(H,38,39)/t26-/m0/s1