methyl 1-(1,3-benzodioxol-5-ylmethyl)-6-oxidanylidene-pyridine-3-carboxylate

Systemtic Name: methyl 1-(1,3-benzodioxol-5-ylmethyl)-6-oxidanylidene-pyridine-3-carboxylate Openeye Name: methyl 1-(1,3-benzodioxol-5-ylmethyl)-6-oxo-pyridine-3-carboxylate CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-6-oxo-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 1-(1,3-benzodioxol-5-ylmethyl)-6-oxopyridine-3-carboxylate Traditional Name: 6-keto-1-piperonyl-nicotinic acid methyl ester Formula: C15H13NO5 MolecularWeight: 287.26742

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(C(=O)C=C1)CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

COC(=O)C1=CN(C(=O)C=C1)CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C15H13NO5/c1-19-15(18)11-3-5-14(17)16(8-11)7-10-2-4-12-13(6-10)21-9-20-12/h2-6,8H,7,9H2,1H3