5-methyl-2-(1-pyrrolidin-3-ylethyl)benzoic acid

Systemtic Name: 5-methyl-2-(1-pyrrolidin-3-ylethyl)benzoic acid Openeye Name: 5-methyl-2-(1-pyrrolidin-3-ylethyl)benzoic acid CAS Name: 5-methyl-2-[1-(3-pyrrolidinyl)ethyl]benzoic acid IUPAC Name: 5-methyl-2-(1-pyrrolidin-3-ylethyl)benzoic acid Traditional Name: 5-methyl-2-(1-pyrrolidin-3-ylethyl)benzoic acid Formula: C14H19NO2 MolecularWeight: 233.30616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C2CCNC2)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C2CCNC2)C(=O)O

InChI

InChI=1S/C14H19NO2/c1-9-3-4-12(13(7-9)14(16)17)10(2)11-5-6-15-8-11/h3-4,7,10-11,15H,5-6,8H2,1-2H3,(H,16,17)