methyl 4-[(1-butyl-2-oxidanyl-4-oxidanylidene-quinolin-3-yl)carbonylamino]benzoate

Systemtic Name: methyl 4-[(1-butyl-2-oxidanyl-4-oxidanylidene-quinolin-3-yl)carbonylamino]benzoate Openeye Name: methyl 4-[(1-butyl-2-hydroxy-4-oxo-quinoline-3-carbonyl)amino]benzoate CAS Name: 4-[[(1-butyl-2-hydroxy-4-oxo-3-quinolinyl)-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[(1-butyl-2-hydroxy-4-oxoquinoline-3-carbonyl)amino]benzoate Traditional Name: 4-[(1-butyl-2-hydroxy-4-keto-quinoline-3-carbonyl)amino]benzoic acid methyl ester Formula: C22H22N2O5 MolecularWeight: 394.42048

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)NC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CCCCN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)NC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C22H22N2O5/c1-3-4-13-24-17-8-6-5-7-16(17)19(25)18(21(24)27)20(26)23-15-11-9-14(10-12-15)22(28)29-2/h5-12,27H,3-4,13H2,1-2H3,(H,23,26)