(6-chloranyl-7-methyl-4-oxidanylidene-2-phenyl-chromen-3-yl) pyridine-4-carboxylate

Systemtic Name: (6-chloranyl-7-methyl-4-oxidanylidene-2-phenyl-chromen-3-yl) pyridine-4-carboxylate Openeye Name: (6-chloro-7-methyl-4-oxo-2-phenyl-chromen-3-yl) pyridine-4-carboxylate CAS Name: 4-pyridinecarboxylic acid (6-chloro-7-methyl-4-oxo-2-phenyl-1-benzopyran-3-yl) ester IUPAC Name: (6-chloro-7-methyl-4-oxo-2-phenylchromen-3-yl) pyridine-4-carboxylate Traditional Name: isonicotinic acid (6-chloro-4-keto-7-methyl-2-phenyl-chromen-3-yl) ester Formula: C22H14ClNO4 MolecularWeight: 391.80386

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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=CC=C4)Cl

Isomeric SMILES

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

InChI

InChI=1S/C22H14ClNO4/c1-13-11-18-16(12-17(13)23)19(25)21(20(27-18)14-5-3-2-4-6-14)28-22(26)15-7-9-24-10-8-15/h2-12H,1H3