4-[2-(2-dimethylaminoethylcarbamoyl)piperazin-1-yl]benzoic acid

Systemtic Name: 4-[2-(2-dimethylaminoethylcarbamoyl)piperazin-1-yl]benzoic acid Openeye Name: 4-[2-(2-dimethylaminoethylcarbamoyl)piperazin-1-yl]benzoic acid CAS Name: 4-[2-[(2-dimethylaminoethylamino)-oxomethyl]-1-piperazinyl]benzoic acid IUPAC Name: 4-[2-(2-dimethylaminoethylcarbamoyl)piperazin-1-yl]benzoic acid Traditional Name: 4-[2-(2-dimethylaminoethylcarbamoyl)piperazino]benzoic acid Formula: C16H24N4O3 MolecularWeight: 320.38676

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC(=O)C1CNCCN1C2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CN(C)CCNC(=O)C1CNCCN1C2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C16H24N4O3/c1-19(2)9-8-18-15(21)14-11-17-7-10-20(14)13-5-3-12(4-6-13)16(22)23/h3-6,14,17H,7-11H2,1-2H3,(H,18,21)(H,22,23)