[2-(4-chlorophenyl)-6,7-dimethyl-4-oxidanylidene-chromen-3-yl] 2-methylquinoline-4-carboxylate

Systemtic Name: [2-(4-chlorophenyl)-6,7-dimethyl-4-oxidanylidene-chromen-3-yl] 2-methylquinoline-4-carboxylate Openeye Name: [2-(4-chlorophenyl)-6,7-dimethyl-4-oxo-chromen-3-yl] 2-methylquinoline-4-carboxylate CAS Name: 2-methyl-4-quinolinecarboxylic acid [2-(4-chlorophenyl)-6,7-dimethyl-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [2-(4-chlorophenyl)-6,7-dimethyl-4-oxochromen-3-yl] 2-methylquinoline-4-carboxylate Traditional Name: 2-methylcinchoninic acid [2-(4-chlorophenyl)-4-keto-6,7-dimethyl-chromen-3-yl] ester Formula: C28H20ClNO4 MolecularWeight: 469.9157

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=O)C(=C(O2)C3=CC=C(C=C3)Cl)OC(=O)C4=CC(=NC5=CC=CC=C54)C)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=O)C(=C(O2)C3=CC=C(C=C3)Cl)OC(=O)C4=CC(=NC5=CC=CC=C54)C)C

InChI

InChI=1S/C28H20ClNO4/c1-15-12-22-24(13-16(15)2)33-26(18-8-10-19(29)11-9-18)27(25(22)31)34-28(32)21-14-17(3)30-23-7-5-4-6-20(21)23/h4-14H,1-3H3