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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C2CCCCC2)N3CCN(CC3)C4=CC=C(C=C4)C(=O)O

Isomeric SMILES

CC(C1=CC=C(C=C1)C2CCCCC2)N3CCN(CC3)C4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C25H32N2O2/c1-19(20-7-9-22(10-8-20)21-5-3-2-4-6-21)26-15-17-27(18-16-26)24-13-11-23(12-14-24)25(28)29/h7-14,19,21H,2-6,15-18H2,1H3,(H,28,29)