4-[4-[[2-(4-chlorophenyl)cyclopenten-1-yl]methyl]piperazin-1-yl]benzoic acid

Systemtic Name: 4-[4-[[2-(4-chlorophenyl)cyclopenten-1-yl]methyl]piperazin-1-yl]benzoic acid Openeye Name: 4-[4-[[2-(4-chlorophenyl)cyclopenten-1-yl]methyl]piperazin-1-yl]benzoic acid CAS Name: 4-[4-[[2-(4-chlorophenyl)-1-cyclopentenyl]methyl]-1-piperazinyl]benzoic acid IUPAC Name: 4-[4-[[2-(4-chlorophenyl)cyclopenten-1-yl]methyl]piperazin-1-yl]benzoic acid Traditional Name: 4-[4-[[2-(4-chlorophenyl)cyclopenten-1-yl]methyl]piperazino]benzoic acid Formula: C23H25ClN2O2 MolecularWeight: 396.9098

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=C(C1)C2=CC=C(C=C2)Cl)CN3CCN(CC3)C4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1CC(=C(C1)C2=CC=C(C=C2)Cl)CN3CCN(CC3)C4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C23H25ClN2O2/c24-20-8-4-17(5-9-20)22-3-1-2-19(22)16-25-12-14-26(15-13-25)21-10-6-18(7-11-21)23(27)28/h4-11H,1-3,12-16H2,(H,27,28)