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

Systemtic Name: 2-[4-[1-(4-cyclohexylphenyl)ethyl]piperazin-1-yl]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[4-[1-(4-cyclohexylphenyl)ethyl]piperazin-1-yl]-2-oxo-acetic acid CAS Name: 2-[4-[1-(4-cyclohexylphenyl)ethyl]-1-piperazinyl]-2-oxoacetic acid IUPAC Name: 2-[4-[1-(4-cyclohexylphenyl)ethyl]piperazin-1-yl]-2-oxoacetic acid Traditional Name: 2-[4-[1-(4-cyclohexylphenyl)ethyl]piperazino]-2-keto-acetic acid Formula: C20H28N2O3 MolecularWeight: 344.44792

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H28N2O3/c1-15(21-11-13-22(14-12-21)19(23)20(24)25)16-7-9-18(10-8-16)17-5-3-2-4-6-17/h7-10,15,17H,2-6,11-14H2,1H3,(H,24,25)