1-(phenylcarbonyl)piperazin-1-ium-1-carboxylic acid

Systemtic Name: 1-(phenylcarbonyl)piperazin-1-ium-1-carboxylic acid Openeye Name: 1-benzoylpiperazin-1-ium-1-carboxylic acid CAS Name: 1-benzoyl-1-piperazin-1-iumcarboxylic acid IUPAC Name: 1-benzoylpiperazin-1-ium-1-carboxylic acid Traditional Name: 1-benzoylpiperazin-1-ium-1-carboxylic acid Formula: C12H15N2O3+ MolecularWeight: 235.2591

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[N+](CCN1)(C(=O)C2=CC=CC=C2)C(=O)O

Isomeric SMILES

C1C[N+](CCN1)(C(=O)C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C12H14N2O3/c15-11(10-4-2-1-3-5-10)14(12(16)17)8-6-13-7-9-14/h1-5,13H,6-9H2/p+1