(4S)-5-oxidanylidene-5-(4-phenylmethoxycarbonylpiperazin-1-yl)-4-[(6-phenylpyridin-2-yl)carbonylamino]pentanoic acid

Systemtic Name: (4S)-5-oxidanylidene-5-(4-phenylmethoxycarbonylpiperazin-1-yl)-4-[(6-phenylpyridin-2-yl)carbonylamino]pentanoic acid Openeye Name: (4S)-5-(4-benzyloxycarbonylpiperazin-1-yl)-5-oxo-4-[(6-phenylpyridine-2-carbonyl)amino]pentanoic acid CAS Name: (4S)-5-oxo-4-[[oxo-(6-phenyl-2-pyridinyl)methyl]amino]-5-(4-phenylmethoxycarbonyl-1-piperazinyl)pentanoic acid IUPAC Name: (4S)-5-oxo-5-(4-phenylmethoxycarbonylpiperazin-1-yl)-4-[(6-phenylpyridine-2-carbonyl)amino]pentanoic acid Traditional Name: (4S)-5-(4-carbobenzoxypiperazino)-5-keto-4-[(6-phenylpicolinoyl)amino]valeric acid Formula: C29H30N4O6 MolecularWeight: 530.5717

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C(CCC(=O)O)NC(=O)C2=CC=CC(=N2)C3=CC=CC=C3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C(=O)[C@H](CCC(=O)O)NC(=O)C2=CC=CC(=N2)C3=CC=CC=C3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C29H30N4O6/c34-26(35)15-14-25(31-27(36)24-13-7-12-23(30-24)22-10-5-2-6-11-22)28(37)32-16-18-33(19-17-32)29(38)39-20-21-8-3-1-4-9-21/h1-13,25H,14-20H2,(H,31,36)(H,34,35)/t25-/m0/s1