(3-oxidanylidenebenzo[f]chromen-1-yl)methyl 2-(3-chlorophenyl)-3-methyl-quinoline-4-carboxylate

Systemtic Name: (3-oxidanylidenebenzo[f]chromen-1-yl)methyl 2-(3-chlorophenyl)-3-methyl-quinoline-4-carboxylate Openeye Name: (3-oxobenzo[f]chromen-1-yl)methyl 2-(3-chlorophenyl)-3-methyl-quinoline-4-carboxylate CAS Name: 2-(3-chlorophenyl)-3-methyl-4-quinolinecarboxylic acid (3-oxo-1-benzo[f][1]benzopyranyl)methyl ester IUPAC Name: (3-oxobenzo[f]chromen-1-yl)methyl 2-(3-chlorophenyl)-3-methylquinoline-4-carboxylate Traditional Name: 2-(3-chlorophenyl)-3-methyl-cinchoninic acid (3-ketobenzo[f]chromen-1-yl)methyl ester Formula: C31H20ClNO4 MolecularWeight: 505.9478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N=C1C3=CC(=CC=C3)Cl)C(=O)OCC4=CC(=O)OC5=C4C6=CC=CC=C6C=C5

Isomeric SMILES

CC1=C(C2=CC=CC=C2N=C1C3=CC(=CC=C3)Cl)C(=O)OCC4=CC(=O)OC5=C4C6=CC=CC=C6C=C5

InChI

InChI=1S/C31H20ClNO4/c1-18-28(24-11-4-5-12-25(24)33-30(18)20-8-6-9-22(32)15-20)31(35)36-17-21-16-27(34)37-26-14-13-19-7-2-3-10-23(19)29(21)26/h2-16H,17H2,1H3