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

Systemtic Name: [6-chloranyl-2-(4-methoxyphenyl)-7-methyl-4-oxidanylidene-chromen-3-yl] pyridine-4-carboxylate Openeye Name: [6-chloro-2-(4-methoxyphenyl)-7-methyl-4-oxo-chromen-3-yl] pyridine-4-carboxylate CAS Name: 4-pyridinecarboxylic acid [6-chloro-2-(4-methoxyphenyl)-7-methyl-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [6-chloro-2-(4-methoxyphenyl)-7-methyl-4-oxochromen-3-yl] pyridine-4-carboxylate Traditional Name: isonicotinic acid [6-chloro-4-keto-2-(4-methoxyphenyl)-7-methyl-chromen-3-yl] ester Formula: C23H16ClNO5 MolecularWeight: 421.82984

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H16ClNO5/c1-13-11-19-17(12-18(13)24)20(26)22(30-23(27)15-7-9-25-10-8-15)21(29-19)14-3-5-16(28-2)6-4-14/h3-12H,1-2H3