ethyl 2-(4-butyl-1-methyl-pyrrol-2-yl)ethanoate

Systemtic Name: ethyl 2-(4-butyl-1-methyl-pyrrol-2-yl)ethanoate Openeye Name: ethyl 2-(4-butyl-1-methyl-pyrrol-2-yl)acetate CAS Name: 2-(4-butyl-1-methyl-2-pyrrolyl)acetic acid ethyl ester IUPAC Name: ethyl 2-(4-butyl-1-methylpyrrol-2-yl)acetate Traditional Name: 2-(4-butyl-1-methyl-pyrrol-2-yl)acetic acid ethyl ester Formula: C13H21NO2 MolecularWeight: 223.31134

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CN(C(=C1)CC(=O)OCC)C

Isomeric SMILES

CCCCC1=CN(C(=C1)CC(=O)OCC)C

InChI

InChI=1S/C13H21NO2/c1-4-6-7-11-8-12(14(3)10-11)9-13(15)16-5-2/h8,10H,4-7,9H2,1-3H3