4-(2-pyrrolidin-1-ylethyl)benzoic acid

Systemtic Name: 4-(2-pyrrolidin-1-ylethyl)benzoic acid Openeye Name: 4-(2-pyrrolidin-1-ylethyl)benzoic acid CAS Name: 4-[2-(1-pyrrolidinyl)ethyl]benzoic acid IUPAC Name: 4-(2-pyrrolidin-1-ylethyl)benzoic acid Traditional Name: 4-(2-pyrrolidinoethyl)benzoic acid Formula: C13H17NO2 MolecularWeight: 219.27958

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

C1CCN(C1)CCC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C13H17NO2/c15-13(16)12-5-3-11(4-6-12)7-10-14-8-1-2-9-14/h3-6H,1-2,7-10H2,(H,15,16)