4-[4-(4-chlorophenyl)piperazin-1-yl]-3-nitro-benzoate

Systemtic Name: 4-[4-(4-chlorophenyl)piperazin-1-yl]-3-nitro-benzoate Openeye Name: 4-[4-(4-chlorophenyl)piperazin-1-yl]-3-nitro-benzoate CAS Name: 4-[4-(4-chlorophenyl)-1-piperazinyl]-3-nitrobenzoate IUPAC Name: 4-[4-(4-chlorophenyl)piperazin-1-yl]-3-nitrobenzoate Traditional Name: 4-[4-(4-chlorophenyl)piperazino]-3-nitro-benzoate Formula: C17H15ClN3O4- MolecularWeight: 360.7717

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)Cl)C3=C(C=C(C=C3)C(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)Cl)C3=C(C=C(C=C3)C(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H16ClN3O4/c18-13-2-4-14(5-3-13)19-7-9-20(10-8-19)15-6-1-12(17(22)23)11-16(15)21(24)25/h1-6,11H,7-10H2,(H,22,23)/p-1