[2-(4-bromophenyl)-2-oxidanylidene-ethyl] 2,5-diphenyl-6-piperidin-1-ylcarbonyl-cyclohex-3-ene-1-carboxylate

Systemtic Name: [2-(4-bromophenyl)-2-oxidanylidene-ethyl] 2,5-diphenyl-6-piperidin-1-ylcarbonyl-cyclohex-3-ene-1-carboxylate Openeye Name: [2-(4-bromophenyl)-2-oxo-ethyl] 2,5-diphenyl-6-(piperidine-1-carbonyl)cyclohex-3-ene-1-carboxylate CAS Name: 6-[oxo(1-piperidinyl)methyl]-2,5-diphenyl-1-cyclohex-3-enecarboxylic acid [2-(4-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-bromophenyl)-2-oxoethyl] 2,5-diphenyl-6-(piperidine-1-carbonyl)cyclohex-3-ene-1-carboxylate Traditional Name: 2,5-diphenyl-6-(piperidine-1-carbonyl)cyclohex-3-ene-1-carboxylic acid [2-(4-bromophenyl)-2-keto-ethyl] ester Formula: C33H32BrNO4 MolecularWeight: 586.51548

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2C(C=CC(C2C(=O)OCC(=O)C3=CC=C(C=C3)Br)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CCN(CC1)C(=O)C2C(C=CC(C2C(=O)OCC(=O)C3=CC=C(C=C3)Br)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C33H32BrNO4/c34-26-16-14-25(15-17-26)29(36)22-39-33(38)31-28(24-12-6-2-7-13-24)19-18-27(23-10-4-1-5-11-23)30(31)32(37)35-20-8-3-9-21-35/h1-2,4-7,10-19,27-28,30-31H,3,8-9,20-22H2