[2-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxidanylidene-ethyl] 2-methylbutanoate

Systemtic Name: [2-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxidanylidene-ethyl] 2-methylbutanoate Openeye Name: [2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxo-ethyl] 2-methylbutanoate CAS Name: 2-methylbutanoic acid [2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxoethyl] ester IUPAC Name: [2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-oxoethyl] 2-methylbutanoate Traditional Name: 2-methylbutyric acid [2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-keto-ethyl] ester Formula: C15H21NO4 MolecularWeight: 279.33154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)OCC(=O)C1=C(C(=C(N1)C)C(=O)C)C

Isomeric SMILES

CCC(C)C(=O)OCC(=O)C1=C(C(=C(N1)C)C(=O)C)C

InChI

InChI=1S/C15H21NO4/c1-6-8(2)15(19)20-7-12(18)14-9(3)13(11(5)17)10(4)16-14/h8,16H,6-7H2,1-5H3