(7-methyl-2-oxidanylidene-chromen-4-yl)methyl 2-(1,2,4-triazol-1-yl)pyridine-3-carboxylate

Systemtic Name: (7-methyl-2-oxidanylidene-chromen-4-yl)methyl 2-(1,2,4-triazol-1-yl)pyridine-3-carboxylate Openeye Name: (7-methyl-2-oxo-chromen-4-yl)methyl 2-(1,2,4-triazol-1-yl)pyridine-3-carboxylate CAS Name: 2-(1,2,4-triazol-1-yl)-3-pyridinecarboxylic acid (7-methyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methyl-2-oxochromen-4-yl)methyl 2-(1,2,4-triazol-1-yl)pyridine-3-carboxylate Traditional Name: 2-(1,2,4-triazol-1-yl)nicotinic acid (2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C19H14N4O4 MolecularWeight: 362.33886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=C(N=CC=C3)N4C=NC=N4

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=C(N=CC=C3)N4C=NC=N4

InChI

InChI=1S/C19H14N4O4/c1-12-4-5-14-13(8-17(24)27-16(14)7-12)9-26-19(25)15-3-2-6-21-18(15)23-11-20-10-22-23/h2-8,10-11H,9H2,1H3