3-(2-butylpyrrolidin-1-yl)carbonylbenzoic acid

Systemtic Name: 3-(2-butylpyrrolidin-1-yl)carbonylbenzoic acid Openeye Name: 3-(2-butylpyrrolidine-1-carbonyl)benzoic acid CAS Name: 3-[(2-butyl-1-pyrrolidinyl)-oxomethyl]benzoic acid IUPAC Name: 3-(2-butylpyrrolidine-1-carbonyl)benzoic acid Traditional Name: 3-(2-butylpyrrolidine-1-carbonyl)benzoic acid Formula: C16H21NO3 MolecularWeight: 275.34284

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCCN1C(=O)C2=CC(=CC=C2)C(=O)O

Isomeric SMILES

CCCCC1CCCN1C(=O)C2=CC(=CC=C2)C(=O)O

InChI

InChI=1S/C16H21NO3/c1-2-3-8-14-9-5-10-17(14)15(18)12-6-4-7-13(11-12)16(19)20/h4,6-7,11,14H,2-3,5,8-10H2,1H3,(H,19,20)