(7-methyl-2-oxidanylidene-chromen-4-yl)methyl 2-(2-chlorophenyl)quinoline-4-carboxylate

Systemtic Name: (7-methyl-2-oxidanylidene-chromen-4-yl)methyl 2-(2-chlorophenyl)quinoline-4-carboxylate Openeye Name: (7-methyl-2-oxo-chromen-4-yl)methyl 2-(2-chlorophenyl)quinoline-4-carboxylate CAS Name: 2-(2-chlorophenyl)-4-quinolinecarboxylic acid (7-methyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methyl-2-oxochromen-4-yl)methyl 2-(2-chlorophenyl)quinoline-4-carboxylate Traditional Name: 2-(2-chlorophenyl)cinchoninic acid (2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C27H18ClNO4 MolecularWeight: 455.88912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5Cl

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5Cl

InChI

InChI=1S/C27H18ClNO4/c1-16-10-11-18-17(13-26(30)33-25(18)12-16)15-32-27(31)21-14-24(20-7-2-4-8-22(20)28)29-23-9-5-3-6-19(21)23/h2-14H,15H2,1H3