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

Systemtic Name: 4-[2-[4-(4-cyclohexylphenyl)piperazin-1-yl]ethyl]benzoic acid Openeye Name: 4-[2-[4-(4-cyclohexylphenyl)piperazin-1-yl]ethyl]benzoic acid CAS Name: 4-[2-[4-(4-cyclohexylphenyl)-1-piperazinyl]ethyl]benzoic acid IUPAC Name: 4-[2-[4-(4-cyclohexylphenyl)piperazin-1-yl]ethyl]benzoic acid Traditional Name: 4-[2-[4-(4-cyclohexylphenyl)piperazino]ethyl]benzoic acid Formula: C25H32N2O2 MolecularWeight: 392.53378

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)N3CCN(CC3)CCC4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)N3CCN(CC3)CCC4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C25H32N2O2/c28-25(29)23-8-6-20(7-9-23)14-15-26-16-18-27(19-17-26)24-12-10-22(11-13-24)21-4-2-1-3-5-21/h6-13,21H,1-5,14-19H2,(H,28,29)