2-[[2-oxidanyl-4-oxidanylidene-7-phenylmethoxy-1-(phenylmethyl)quinolin-3-yl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[2-oxidanyl-4-oxidanylidene-7-phenylmethoxy-1-(phenylmethyl)quinolin-3-yl]carbonylamino]ethanoic acid Openeye Name: 2-[(1-benzyl-7-benzyloxy-2-hydroxy-4-oxo-quinoline-3-carbonyl)amino]acetic acid CAS Name: 2-[[[2-hydroxy-4-oxo-7-phenylmethoxy-1-(phenylmethyl)-3-quinolinyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[(1-benzyl-2-hydroxy-4-oxo-7-phenylmethoxyquinoline-3-carbonyl)amino]acetic acid Traditional Name: 2-[(7-benzoxy-1-benzyl-2-hydroxy-4-keto-quinoline-3-carbonyl)amino]acetic acid Formula: C26H22N2O6 MolecularWeight: 458.46268

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=C(C=CC(=C3)OCC4=CC=CC=C4)C(=O)C(=C2O)C(=O)NCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=C(C=CC(=C3)OCC4=CC=CC=C4)C(=O)C(=C2O)C(=O)NCC(=O)O

InChI

InChI=1S/C26H22N2O6/c29-22(30)14-27-25(32)23-24(31)20-12-11-19(34-16-18-9-5-2-6-10-18)13-21(20)28(26(23)33)15-17-7-3-1-4-8-17/h1-13,33H,14-16H2,(H,27,32)(H,29,30)