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

Systemtic Name: (6-ethyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl pyridine-4-carboxylate Openeye Name: (6-ethyl-7-hydroxy-2-oxo-chromen-4-yl)methyl pyridine-4-carboxylate CAS Name: 4-pyridinecarboxylic acid (6-ethyl-7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6-ethyl-7-hydroxy-2-oxochromen-4-yl)methyl pyridine-4-carboxylate Traditional Name: isonicotinic acid (6-ethyl-7-hydroxy-2-keto-chromen-4-yl)methyl ester Formula: C18H15NO5 MolecularWeight: 325.3154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)C3=CC=NC=C3)O

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)C3=CC=NC=C3)O

InChI

InChI=1S/C18H15NO5/c1-2-11-7-14-13(8-17(21)24-16(14)9-15(11)20)10-23-18(22)12-3-5-19-6-4-12/h3-9,20H,2,10H2,1H3