(1R,6R)-6-(4-phenylpiperazin-1-yl)carbonylcyclohex-3-ene-1-carboxylate

Systemtic Name: (1R,6R)-6-(4-phenylpiperazin-1-yl)carbonylcyclohex-3-ene-1-carboxylate Openeye Name: (1R,6R)-6-(4-phenylpiperazine-1-carbonyl)cyclohex-3-ene-1-carboxylate CAS Name: (1R,6R)-6-[oxo-(4-phenyl-1-piperazinyl)methyl]-1-cyclohex-3-enecarboxylate IUPAC Name: (1R,6R)-6-(4-phenylpiperazine-1-carbonyl)cyclohex-3-ene-1-carboxylate Traditional Name: (1R,6R)-6-(4-phenylpiperazine-1-carbonyl)cyclohex-3-ene-1-carboxylate Formula: C18H21N2O3- MolecularWeight: 313.37094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)C3CC=CCC3C(=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)[C@@H]3CC=CC[C@H]3C(=O)[O-]

InChI

InChI=1S/C18H22N2O3/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/h1-7,15-16H,8-13H2,(H,22,23)/p-1/t15-,16-/m1/s1