(8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl pyridine-4-carboxylate

Systemtic Name: (8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl pyridine-4-carboxylate Openeye Name: (7-hydroxy-8-methyl-2-oxo-chromen-4-yl)methyl pyridine-4-carboxylate CAS Name: 4-pyridinecarboxylic acid (7-hydroxy-8-methyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-hydroxy-8-methyl-2-oxochromen-4-yl)methyl pyridine-4-carboxylate Traditional Name: isonicotinic acid (7-hydroxy-2-keto-8-methyl-chromen-4-yl)methyl ester Formula: C17H13NO5 MolecularWeight: 311.28882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C=C2COC(=O)C3=CC=NC=C3)O

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C=C2COC(=O)C3=CC=NC=C3)O

InChI

InChI=1S/C17H13NO5/c1-10-14(19)3-2-13-12(8-15(20)23-16(10)13)9-22-17(21)11-4-6-18-7-5-11/h2-8,19H,9H2,1H3