(1R,6R)-6-[[2-(4-phenylpiperazin-1-yl)carbonylphenyl]carbamoyl]cyclohex-3-ene-1-carboxylate

Systemtic Name: (1R,6R)-6-[[2-(4-phenylpiperazin-1-yl)carbonylphenyl]carbamoyl]cyclohex-3-ene-1-carboxylate Openeye Name: (1R,6R)-6-[[2-(4-phenylpiperazine-1-carbonyl)phenyl]carbamoyl]cyclohex-3-ene-1-carboxylate CAS Name: (1R,6R)-6-[oxo-[2-[oxo-(4-phenyl-1-piperazinyl)methyl]anilino]methyl]-1-cyclohex-3-enecarboxylate IUPAC Name: (1R,6R)-6-[[2-(4-phenylpiperazine-1-carbonyl)phenyl]carbamoyl]cyclohex-3-ene-1-carboxylate Traditional Name: (1R,6R)-6-[[2-(4-phenylpiperazine-1-carbonyl)phenyl]carbamoyl]cyclohex-3-ene-1-carboxylate Formula: C25H26N3O4- MolecularWeight: 432.49164

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)C3=CC=CC=C3NC(=O)C4CC=CCC4C(=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)C3=CC=CC=C3NC(=O)[C@@H]4CC=CC[C@H]4C(=O)[O-]

InChI

InChI=1S/C25H27N3O4/c29-23(19-10-4-5-11-20(19)25(31)32)26-22-13-7-6-12-21(22)24(30)28-16-14-27(15-17-28)18-8-2-1-3-9-18/h1-9,12-13,19-20H,10-11,14-17H2,(H,26,29)(H,31,32)/p-1/t19-,20-/m1/s1