[2-(furan-2-yl)-6,7-dimethyl-4-oxidanylidene-chromen-3-yl] pyridine-4-carboxylate

Systemtic Name: [2-(furan-2-yl)-6,7-dimethyl-4-oxidanylidene-chromen-3-yl] pyridine-4-carboxylate Openeye Name: [2-(2-furyl)-6,7-dimethyl-4-oxo-chromen-3-yl] pyridine-4-carboxylate CAS Name: 4-pyridinecarboxylic acid [2-(2-furanyl)-6,7-dimethyl-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [2-(furan-2-yl)-6,7-dimethyl-4-oxochromen-3-yl] pyridine-4-carboxylate Traditional Name: isonicotinic acid [2-(2-furyl)-4-keto-6,7-dimethyl-chromen-3-yl] ester Formula: C21H15NO5 MolecularWeight: 361.3475

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=O)C(=C(O2)C3=CC=CO3)OC(=O)C4=CC=NC=C4)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=O)C(=C(O2)C3=CC=CO3)OC(=O)C4=CC=NC=C4)C

InChI

InChI=1S/C21H15NO5/c1-12-10-15-17(11-13(12)2)26-19(16-4-3-9-25-16)20(18(15)23)27-21(24)14-5-7-22-8-6-14/h3-11H,1-2H3