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

Systemtic Name: (6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl quinoline-2-carboxylate Openeye Name: (6-chloro-7-methyl-2-oxo-chromen-4-yl)methyl quinoline-2-carboxylate CAS Name: 2-quinolinecarboxylic acid (6-chloro-7-methyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6-chloro-7-methyl-2-oxochromen-4-yl)methyl quinoline-2-carboxylate Traditional Name: quinaldic acid (6-chloro-2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C21H14ClNO4 MolecularWeight: 379.79316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C3=NC4=CC=CC=C4C=C3)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C3=NC4=CC=CC=C4C=C3)Cl

InChI

InChI=1S/C21H14ClNO4/c1-12-8-19-15(10-16(12)22)14(9-20(24)27-19)11-26-21(25)18-7-6-13-4-2-3-5-17(13)23-18/h2-10H,11H2,1H3