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

Systemtic Name: (4S)-5-oxidanylidene-5-(4-pentoxycarbonylpiperazin-1-yl)-4-[(6-phenyl-4-propoxy-pyridin-2-yl)carbonylamino]pentanoic acid Openeye Name: (4S)-5-oxo-5-(4-pentoxycarbonylpiperazin-1-yl)-4-[(6-phenyl-4-propoxy-pyridine-2-carbonyl)amino]pentanoic acid CAS Name: (4S)-5-oxo-5-[4-[oxo(pentoxy)methyl]-1-piperazinyl]-4-[[oxo-(6-phenyl-4-propoxy-2-pyridinyl)methyl]amino]pentanoic acid IUPAC Name: (4S)-5-oxo-5-(4-pentoxycarbonylpiperazin-1-yl)-4-[(6-phenyl-4-propoxypyridine-2-carbonyl)amino]pentanoic acid Traditional Name: (4S)-5-(4-amoxycarbonylpiperazino)-5-keto-4-[(6-phenyl-4-propoxy-picolinoyl)amino]valeric acid Formula: C30H40N4O7 MolecularWeight: 568.6612

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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)OCCC

Isomeric SMILES

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

InChI

InChI=1S/C30H40N4O7/c1-3-5-9-19-41-30(39)34-16-14-33(15-17-34)29(38)24(12-13-27(35)36)32-28(37)26-21-23(40-18-4-2)20-25(31-26)22-10-7-6-8-11-22/h6-8,10-11,20-21,24H,3-5,9,12-19H2,1-2H3,(H,32,37)(H,35,36)/t24-/m0/s1