2-[[2-[4-(2-methylphenyl)piperazin-1-yl]phenyl]carbamoyl]cyclohexane-1-carboxylic acid

Systemtic Name: 2-[[2-[4-(2-methylphenyl)piperazin-1-yl]phenyl]carbamoyl]cyclohexane-1-carboxylic acid Openeye Name: 2-[[2-[4-(o-tolyl)piperazin-1-yl]phenyl]carbamoyl]cyclohexanecarboxylic acid CAS Name: 2-[[2-[4-(2-methylphenyl)-1-piperazinyl]anilino]-oxomethyl]-1-cyclohexanecarboxylic acid IUPAC Name: 2-[[2-[4-(2-methylphenyl)piperazin-1-yl]phenyl]carbamoyl]cyclohexane-1-carboxylic acid Traditional Name: 2-[[2-[4-(o-tolyl)piperazino]phenyl]carbamoyl]cyclohexanecarboxylic acid Formula: C25H31N3O3 MolecularWeight: 421.53194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)C3=CC=CC=C3NC(=O)C4CCCCC4C(=O)O

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)C3=CC=CC=C3NC(=O)C4CCCCC4C(=O)O

InChI

InChI=1S/C25H31N3O3/c1-18-8-2-6-12-22(18)27-14-16-28(17-15-27)23-13-7-5-11-21(23)26-24(29)19-9-3-4-10-20(19)25(30)31/h2,5-8,11-13,19-20H,3-4,9-10,14-17H2,1H3,(H,26,29)(H,30,31)