(1R,2R)-2-[4-(3-chlorophenyl)piperazin-1-yl]carbonylcyclohexane-1-carboxylate

Systemtic Name: (1R,2R)-2-[4-(3-chlorophenyl)piperazin-1-yl]carbonylcyclohexane-1-carboxylate Openeye Name: (1R,2R)-2-[4-(3-chlorophenyl)piperazine-1-carbonyl]cyclohexanecarboxylate CAS Name: (1R,2R)-2-[[4-(3-chlorophenyl)-1-piperazinyl]-oxomethyl]-1-cyclohexanecarboxylate IUPAC Name: (1R,2R)-2-[4-(3-chlorophenyl)piperazine-1-carbonyl]cyclohexane-1-carboxylate Traditional Name: (1R,2R)-2-[4-(3-chlorophenyl)piperazine-1-carbonyl]cyclohexanecarboxylate Formula: C18H22ClN2O3- MolecularWeight: 349.83188

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl)C(=O)[O-]

Isomeric SMILES

C1CC[C@H]([C@@H](C1)C(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl)C(=O)[O-]

InChI

InChI=1S/C18H23ClN2O3/c19-13-4-3-5-14(12-13)20-8-10-21(11-9-20)17(22)15-6-1-2-7-16(15)18(23)24/h3-5,12,15-16H,1-2,6-11H2,(H,23,24)/p-1/t15-,16-/m1/s1