4-[1-[(4-fluorophenyl)carbonylamino]piperazin-1-ium-1-yl]carbonylbenzoic acid

Systemtic Name: 4-[1-[(4-fluorophenyl)carbonylamino]piperazin-1-ium-1-yl]carbonylbenzoic acid Openeye Name: 4-[1-[(4-fluorobenzoyl)amino]piperazin-1-ium-1-carbonyl]benzoic acid CAS Name: 4-[[1-[[(4-fluorophenyl)-oxomethyl]amino]-1-piperazin-1-iumyl]-oxomethyl]benzoic acid IUPAC Name: 4-[1-[(4-fluorobenzoyl)amino]piperazin-1-ium-1-carbonyl]benzoic acid Traditional Name: 4-[1-[(4-fluorobenzoyl)amino]piperazin-1-ium-1-carbonyl]benzoic acid Formula: C19H19FN3O4+ MolecularWeight: 372.370263

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+](CCN1)(C(=O)C2=CC=C(C=C2)C(=O)O)NC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1C[N+](CCN1)(C(=O)C2=CC=C(C=C2)C(=O)O)NC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C19H18FN3O4/c20-16-7-5-13(6-8-16)17(24)22-23(11-9-21-10-12-23)18(25)14-1-3-15(4-2-14)19(26)27/h1-8,21H,9-12H2,(H-,22,24,26,27)/p+1