7-[(3-methyl-4-oxidanylidene-2-phenyl-chromen-8-yl)carbonylamino]quinoline-3-carboxylic acid

Systemtic Name: 7-[(3-methyl-4-oxidanylidene-2-phenyl-chromen-8-yl)carbonylamino]quinoline-3-carboxylic acid Openeye Name: 7-[(3-methyl-4-oxo-2-phenyl-chromene-8-carbonyl)amino]quinoline-3-carboxylic acid CAS Name: 7-[[(3-methyl-4-oxo-2-phenyl-1-benzopyran-8-yl)-oxomethyl]amino]-3-quinolinecarboxylic acid IUPAC Name: 7-[(3-methyl-4-oxo-2-phenylchromene-8-carbonyl)amino]quinoline-3-carboxylic acid Traditional Name: 7-[(4-keto-3-methyl-2-phenyl-chromene-8-carbonyl)amino]quinoline-3-carboxylic acid Formula: C27H18N2O5 MolecularWeight: 450.44222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C(C1=O)C=CC=C2C(=O)NC3=CC4=NC=C(C=C4C=C3)C(=O)O)C5=CC=CC=C5

Isomeric SMILES

CC1=C(OC2=C(C1=O)C=CC=C2C(=O)NC3=CC4=NC=C(C=C4C=C3)C(=O)O)C5=CC=CC=C5

InChI

InChI=1S/C27H18N2O5/c1-15-23(30)20-8-5-9-21(25(20)34-24(15)16-6-3-2-4-7-16)26(31)29-19-11-10-17-12-18(27(32)33)14-28-22(17)13-19/h2-14H,1H3,(H,29,31)(H,32,33)