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

Systemtic Name: (6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl pyridine-4-carboxylate Openeye Name: (6-chloro-7-methyl-2-oxo-chromen-4-yl)methyl pyridine-4-carboxylate CAS Name: 4-pyridinecarboxylic acid (6-chloro-7-methyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6-chloro-7-methyl-2-oxochromen-4-yl)methyl pyridine-4-carboxylate Traditional Name: isonicotinic acid (6-chloro-2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C17H12ClNO4 MolecularWeight: 329.73448

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H12ClNO4/c1-10-6-15-13(8-14(10)18)12(7-16(20)23-15)9-22-17(21)11-2-4-19-5-3-11/h2-8H,9H2,1H3