[6-chloranyl-2-(4-chlorophenyl)-7-methyl-4-oxidanylidene-chromen-3-yl] pyridine-3-carboxylate

Systemtic Name: [6-chloranyl-2-(4-chlorophenyl)-7-methyl-4-oxidanylidene-chromen-3-yl] pyridine-3-carboxylate Openeye Name: [6-chloro-2-(4-chlorophenyl)-7-methyl-4-oxo-chromen-3-yl] pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [6-chloro-2-(4-chlorophenyl)-7-methyl-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [6-chloro-2-(4-chlorophenyl)-7-methyl-4-oxochromen-3-yl] pyridine-3-carboxylate Traditional Name: nicotinic acid [6-chloro-2-(4-chlorophenyl)-4-keto-7-methyl-chromen-3-yl] ester Formula: C22H13Cl2NO4 MolecularWeight: 426.24892

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)OC(=C(C2=O)OC(=O)C3=CN=CC=C3)C4=CC=C(C=C4)Cl)Cl

Isomeric SMILES

CC1=C(C=C2C(=C1)OC(=C(C2=O)OC(=O)C3=CN=CC=C3)C4=CC=C(C=C4)Cl)Cl

InChI

InChI=1S/C22H13Cl2NO4/c1-12-9-18-16(10-17(12)24)19(26)21(29-22(27)14-3-2-8-25-11-14)20(28-18)13-4-6-15(23)7-5-13/h2-11H,1H3