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

Systemtic Name: 2-[4-(2-cyclohexylethyl)piperazin-1-yl]benzoic acid Openeye Name: 2-[4-(2-cyclohexylethyl)piperazin-1-yl]benzoic acid CAS Name: 2-[4-(2-cyclohexylethyl)-1-piperazinyl]benzoic acid IUPAC Name: 2-[4-(2-cyclohexylethyl)piperazin-1-yl]benzoic acid Traditional Name: 2-[4-(2-cyclohexylethyl)piperazino]benzoic acid Formula: C19H28N2O2 MolecularWeight: 316.43782

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCN2CCN(CC2)C3=CC=CC=C3C(=O)O

Isomeric SMILES

C1CCC(CC1)CCN2CCN(CC2)C3=CC=CC=C3C(=O)O

InChI

InChI=1S/C19H28N2O2/c22-19(23)17-8-4-5-9-18(17)21-14-12-20(13-15-21)11-10-16-6-2-1-3-7-16/h4-5,8-9,16H,1-3,6-7,10-15H2,(H,22,23)