3-pyrrolidin-1-ylcarbonylbenzoic acid

Systemtic Name: 3-pyrrolidin-1-ylcarbonylbenzoic acid Openeye Name: 3-(pyrrolidine-1-carbonyl)benzoic acid CAS Name: 3-[oxo(1-pyrrolidinyl)methyl]benzoic acid IUPAC Name: 3-(pyrrolidine-1-carbonyl)benzoic acid Traditional Name: 3-(pyrrolidine-1-carbonyl)benzoic acid Formula: C12H13NO3 MolecularWeight: 219.23652

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13NO3/c14-11(13-6-1-2-7-13)9-4-3-5-10(8-9)12(15)16/h3-5,8H,1-2,6-7H2,(H,15,16)