(1R,2R)-2-[4-(phenylcarbonyl)piperazin-1-yl]cyclohexane-1-carboxylic acid

Systemtic Name: (1R,2R)-2-[4-(phenylcarbonyl)piperazin-1-yl]cyclohexane-1-carboxylic acid Openeye Name: (1R,2R)-2-(4-benzoylpiperazin-1-yl)cyclohexanecarboxylic acid CAS Name: (1R,2R)-2-(4-benzoyl-1-piperazinyl)-1-cyclohexanecarboxylic acid IUPAC Name: (1R,2R)-2-(4-benzoylpiperazin-1-yl)cyclohexane-1-carboxylic acid Traditional Name: (1R,2R)-2-(4-benzoylpiperazino)cyclohexanecarboxylic acid Formula: C18H24N2O3 MolecularWeight: 316.39476

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C(=O)O)N2CCN(CC2)C(=O)C3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C18H24N2O3/c21-17(14-6-2-1-3-7-14)20-12-10-19(11-13-20)16-9-5-4-8-15(16)18(22)23/h1-3,6-7,15-16H,4-5,8-13H2,(H,22,23)/t15-,16-/m1/s1