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

Systemtic Name: 3-[4-[1-(4-cyclohexylphenyl)ethyl]piperazin-1-yl]propanoic acid Openeye Name: 3-[4-[1-(4-cyclohexylphenyl)ethyl]piperazin-1-yl]propanoic acid CAS Name: 3-[4-[1-(4-cyclohexylphenyl)ethyl]-1-piperazinyl]propanoic acid IUPAC Name: 3-[4-[1-(4-cyclohexylphenyl)ethyl]piperazin-1-yl]propanoic acid Traditional Name: 3-[4-[1-(4-cyclohexylphenyl)ethyl]piperazino]propionic acid Formula: C21H32N2O2 MolecularWeight: 344.49098

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H32N2O2/c1-17(23-15-13-22(14-16-23)12-11-21(24)25)18-7-9-20(10-8-18)19-5-3-2-4-6-19/h7-10,17,19H,2-6,11-16H2,1H3,(H,24,25)