methyl 1-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethyl]-6-oxidanylidene-pyridine-3-carboxylate

Systemtic Name: methyl 1-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethyl]-6-oxidanylidene-pyridine-3-carboxylate Openeye Name: methyl 1-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxo-ethyl]-6-oxo-pyridine-3-carboxylate CAS Name: 1-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl]-6-oxo-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl]-6-oxopyridine-3-carboxylate Traditional Name: 6-keto-1-[2-keto-2-(piperonylamino)ethyl]nicotinic acid methyl ester Formula: C17H16N2O6 MolecularWeight: 344.31874

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(C(=O)C=C1)CC(=O)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

COC(=O)C1=CN(C(=O)C=C1)CC(=O)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H16N2O6/c1-23-17(22)12-3-5-16(21)19(8-12)9-15(20)18-7-11-2-4-13-14(6-11)25-10-24-13/h2-6,8H,7,9-10H2,1H3,(H,18,20)