methyl 1-[2-(3-methylbutylamino)-2-oxidanylidene-ethyl]-6-oxidanylidene-pyridine-3-carboxylate

Systemtic Name: methyl 1-[2-(3-methylbutylamino)-2-oxidanylidene-ethyl]-6-oxidanylidene-pyridine-3-carboxylate Openeye Name: methyl 1-[2-(isopentylamino)-2-oxo-ethyl]-6-oxo-pyridine-3-carboxylate CAS Name: 1-[2-(3-methylbutylamino)-2-oxoethyl]-6-oxo-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(3-methylbutylamino)-2-oxoethyl]-6-oxopyridine-3-carboxylate Traditional Name: 1-[2-(isoamylamino)-2-keto-ethyl]-6-keto-nicotinic acid methyl ester Formula: C14H20N2O4 MolecularWeight: 280.3196

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)CN1C=C(C=CC1=O)C(=O)OC

Isomeric SMILES

CC(C)CCNC(=O)CN1C=C(C=CC1=O)C(=O)OC

InChI

InChI=1S/C14H20N2O4/c1-10(2)6-7-15-12(17)9-16-8-11(14(19)20-3)4-5-13(16)18/h4-5,8,10H,6-7,9H2,1-3H3,(H,15,17)