(1R,2S)-2-(4-phenylpiperazin-1-yl)carbonylcyclohexane-1-carboxylate

Systemtic Name: (1R,2S)-2-(4-phenylpiperazin-1-yl)carbonylcyclohexane-1-carboxylate Openeye Name: (1R,2S)-2-(4-phenylpiperazine-1-carbonyl)cyclohexanecarboxylate CAS Name: (1R,2S)-2-[oxo-(4-phenyl-1-piperazinyl)methyl]-1-cyclohexanecarboxylate IUPAC Name: (1R,2S)-2-(4-phenylpiperazine-1-carbonyl)cyclohexane-1-carboxylate Traditional Name: (1R,2S)-2-(4-phenylpiperazine-1-carbonyl)cyclohexanecarboxylate Formula: C18H23N2O3- MolecularWeight: 315.38682

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H24N2O3/c21-17(15-8-4-5-9-16(15)18(22)23)20-12-10-19(11-13-20)14-6-2-1-3-7-14/h1-3,6-7,15-16H,4-5,8-13H2,(H,22,23)/p-1/t15-,16+/m0/s1