ethyl 3-methyl-2-pyrrol-1-yl-pentanoate

Systemtic Name: ethyl 3-methyl-2-pyrrol-1-yl-pentanoate Openeye Name: ethyl 3-methyl-2-pyrrol-1-yl-pentanoate CAS Name: 3-methyl-2-(1-pyrrolyl)pentanoic acid ethyl ester IUPAC Name: ethyl 3-methyl-2-pyrrol-1-ylpentanoate Traditional Name: 3-methyl-2-pyrrol-1-yl-valeric acid ethyl ester Formula: C12H19NO2 MolecularWeight: 209.28476

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OCC)N1C=CC=C1

Isomeric SMILES

CCC(C)C(C(=O)OCC)N1C=CC=C1

InChI

InChI=1S/C12H19NO2/c1-4-10(3)11(12(14)15-5-2)13-8-6-7-9-13/h6-11H,4-5H2,1-3H3