2-[4-(3-chlorophenyl)piperazin-1-yl]carbonylbenzoic acid

Systemtic Name: 2-[4-(3-chlorophenyl)piperazin-1-yl]carbonylbenzoic acid Openeye Name: 2-[4-(3-chlorophenyl)piperazine-1-carbonyl]benzoic acid CAS Name: 2-[[4-(3-chlorophenyl)-1-piperazinyl]-oxomethyl]benzoic acid IUPAC Name: 2-[4-(3-chlorophenyl)piperazine-1-carbonyl]benzoic acid Traditional Name: 2-[4-(3-chlorophenyl)piperazine-1-carbonyl]benzoic acid Formula: C18H17ClN2O3 MolecularWeight: 344.79218

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)C3=CC=CC=C3C(=O)O

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)C3=CC=CC=C3C(=O)O

InChI

InChI=1S/C18H17ClN2O3/c19-13-4-3-5-14(12-13)20-8-10-21(11-9-20)17(22)15-6-1-2-7-16(15)18(23)24/h1-7,12H,8-11H2,(H,23,24)