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

Systemtic Name: (1R,2R)-2-[4-(4-propylphenyl)piperazin-1-yl]carbonylcyclohexane-1-carboxylate Openeye Name: (1R,2R)-2-[4-(4-propylphenyl)piperazine-1-carbonyl]cyclohexanecarboxylate CAS Name: (1R,2R)-2-[oxo-[4-(4-propylphenyl)-1-piperazinyl]methyl]-1-cyclohexanecarboxylate IUPAC Name: (1R,2R)-2-[4-(4-propylphenyl)piperazine-1-carbonyl]cyclohexane-1-carboxylate Traditional Name: (1R,2R)-2-[4-(4-propylphenyl)piperazine-1-carbonyl]cyclohexanecarboxylate Formula: C21H29N2O3- MolecularWeight: 357.46656

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3CCCCC3C(=O)[O-]

Isomeric SMILES

CCCC1=CC=C(C=C1)N2CCN(CC2)C(=O)[C@@H]3CCCC[C@H]3C(=O)[O-]

InChI

InChI=1S/C21H30N2O3/c1-2-5-16-8-10-17(11-9-16)22-12-14-23(15-13-22)20(24)18-6-3-4-7-19(18)21(25)26/h8-11,18-19H,2-7,12-15H2,1H3,(H,25,26)/p-1/t18-,19-/m1/s1