2-(1-butyl-1-methyl-pyrrol-1-ium-2-yl)ethanoic acid

Systemtic Name: 2-(1-butyl-1-methyl-pyrrol-1-ium-2-yl)ethanoic acid Openeye Name: 2-(1-butyl-1-methyl-pyrrol-1-ium-2-yl)acetic acid CAS Name: 2-(1-butyl-1-methyl-2-pyrrol-1-iumyl)acetic acid IUPAC Name: 2-(1-butyl-1-methylpyrrol-1-ium-2-yl)acetic acid Traditional Name: 2-(1-butyl-1-methyl-pyrrol-1-ium-2-yl)acetic acid Formula: C11H18NO2+ MolecularWeight: 196.26612

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+]1(C=CC=C1CC(=O)O)C

Isomeric SMILES

CCCC[N+]1(C=CC=C1CC(=O)O)C

InChI

InChI=1S/C11H17NO2/c1-3-4-7-12(2)8-5-6-10(12)9-11(13)14/h5-6,8H,3-4,7,9H2,1-2H3/p+1