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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21NO4/c1-5-6-7-13(19)20-8-12(18)15-9(2)14(11(4)17)10(3)16-15/h16H,5-8H2,1-4H3