1-[3-oxidanyl-4-[[2-(2-oxidanylidene-1H-quinolin-3-yl)-1H-indol-5-yl]carbonylamino]butanoyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[3-oxidanyl-4-[[2-(2-oxidanylidene-1H-quinolin-3-yl)-1H-indol-5-yl]carbonylamino]butanoyl]piperidine-4-carboxylic acid Openeye Name: 1-[3-hydroxy-4-[[2-(2-oxo-1H-quinolin-3-yl)-1H-indole-5-carbonyl]amino]butanoyl]piperidine-4-carboxylic acid CAS Name: 1-[3-hydroxy-1-oxo-4-[[oxo-[2-(2-oxo-1H-quinolin-3-yl)-1H-indol-5-yl]methyl]amino]butyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[3-hydroxy-4-[[2-(2-oxo-1H-quinolin-3-yl)-1H-indole-5-carbonyl]amino]butanoyl]piperidine-4-carboxylic acid Traditional Name: 1-[3-hydroxy-4-[[2-(2-keto-1H-quinolin-3-yl)-1H-indole-5-carbonyl]amino]butanoyl]isonipecotic acid Formula: C28H28N4O6 MolecularWeight: 516.54512

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C(=O)CC(CNC(=O)C2=CC3=C(C=C2)NC(=C3)C4=CC5=CC=CC=C5NC4=O)O

Isomeric SMILES

C1CN(CCC1C(=O)O)C(=O)CC(CNC(=O)C2=CC3=C(C=C2)NC(=C3)C4=CC5=CC=CC=C5NC4=O)O

InChI

InChI=1S/C28H28N4O6/c33-20(14-25(34)32-9-7-16(8-10-32)28(37)38)15-29-26(35)18-5-6-23-19(11-18)13-24(30-23)21-12-17-3-1-2-4-22(17)31-27(21)36/h1-6,11-13,16,20,30,33H,7-10,14-15H2,(H,29,35)(H,31,36)(H,37,38)