methyl 2-(4-methoxy-3-methyl-4-oxidanylidene-butyl)pyridine-3-carboxylate

Systemtic Name: methyl 2-(4-methoxy-3-methyl-4-oxidanylidene-butyl)pyridine-3-carboxylate Openeye Name: methyl 2-(4-methoxy-3-methyl-4-oxo-butyl)pyridine-3-carboxylate CAS Name: 2-(4-methoxy-3-methyl-4-oxobutyl)-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 2-(4-methoxy-3-methyl-4-oxobutyl)pyridine-3-carboxylate Traditional Name: 2-(4-keto-4-methoxy-3-methyl-butyl)nicotinic acid methyl ester Formula: C13H17NO4 MolecularWeight: 251.27838

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=C(C=CC=N1)C(=O)OC)C(=O)OC

Isomeric SMILES

CC(CCC1=C(C=CC=N1)C(=O)OC)C(=O)OC

InChI

InChI=1S/C13H17NO4/c1-9(12(15)17-2)6-7-11-10(13(16)18-3)5-4-8-14-11/h4-5,8-9H,6-7H2,1-3H3