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3-[4-[1-(4-cyclohexylphenyl)ethyl]piperazin-1-yl]benzoic acid

3-[4-[1-(4-cyclohexylphenyl)ethyl]piperazin-1-yl]benzoic acid

Systemtic Name:3-[4-[1-(4-cyclohexylphenyl)ethyl]piperazin-1-yl]benzoic acid
Openeye Name:3-[4-[1-(4-cyclohexylphenyl)ethyl]piperazin-1-yl]benzoic acid
CAS Name:3-[4-[1-(4-cyclohexylphenyl)ethyl]-1-piperazinyl]benzoic acid
IUPAC Name:3-[4-[1-(4-cyclohexylphenyl)ethyl]piperazin-1-yl]benzoic acid
Traditional Name:3-[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=CC(=C4)C(=O)O


Isomeric SMILES

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


InChI

InChI=1S/C25H32N2O2/c1-19(20-10-12-22(13-11-20)21-6-3-2-4-7-21)26-14-16-27(17-15-26)24-9-5-8-23(18-24)25(28)29/h5,8-13,18-19,21H,2-4,6-7,14-17H2,1H3,(H,28,29)


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