6-(1,3-benzodioxol-5-yl)-4-(4-methoxyphenyl)-2-oxidanylidene-1H-pyridine-3-carbonitrile

Systemtic Name: 6-(1,3-benzodioxol-5-yl)-4-(4-methoxyphenyl)-2-oxidanylidene-1H-pyridine-3-carbonitrile Openeye Name: 6-(1,3-benzodioxol-5-yl)-4-(4-methoxyphenyl)-2-oxo-1H-pyridine-3-carbonitrile CAS Name: 6-(1,3-benzodioxol-5-yl)-4-(4-methoxyphenyl)-2-oxo-1H-pyridine-3-carbonitrile IUPAC Name: 6-(1,3-benzodioxol-5-yl)-4-(4-methoxyphenyl)-2-oxo-1H-pyridine-3-carbonitrile Traditional Name: 6-(1,3-benzodioxol-5-yl)-2-keto-4-(4-methoxyphenyl)-1H-pyridine-3-carbonitrile Formula: C20H14N2O4 MolecularWeight: 346.33616

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C(=O)NC(=C2)C3=CC4=C(C=C3)OCO4)C#N

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C(=O)NC(=C2)C3=CC4=C(C=C3)OCO4)C#N

InChI

InChI=1S/C20H14N2O4/c1-24-14-5-2-12(3-6-14)15-9-17(22-20(23)16(15)10-21)13-4-7-18-19(8-13)26-11-25-18/h2-9H,11H2,1H3,(H,22,23)