ethyl 1-cyano-2,6-bis(3-methoxyphenyl)-4-oxidanyl-4-phenyl-3-(phenylcarbonyl)cyclohexane-1-carboxylate

Systemtic Name: ethyl 1-cyano-2,6-bis(3-methoxyphenyl)-4-oxidanyl-4-phenyl-3-(phenylcarbonyl)cyclohexane-1-carboxylate Openeye Name: ethyl 3-benzoyl-1-cyano-4-hydroxy-2,6-bis(3-methoxyphenyl)-4-phenyl-cyclohexanecarboxylate CAS Name: 3-benzoyl-1-cyano-4-hydroxy-2,6-bis(3-methoxyphenyl)-4-phenyl-1-cyclohexanecarboxylic acid ethyl ester IUPAC Name: ethyl 3-benzoyl-1-cyano-4-hydroxy-2,6-bis(3-methoxyphenyl)-4-phenylcyclohexane-1-carboxylate Traditional Name: 3-benzoyl-1-cyano-4-hydroxy-2,6-bis(3-methoxyphenyl)-4-phenyl-cyclohexanecarboxylic acid ethyl ester Formula: C37H35NO6 MolecularWeight: 589.6769

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C(CC(C(C1C2=CC(=CC=C2)OC)C(=O)C3=CC=CC=C3)(C4=CC=CC=C4)O)C5=CC(=CC=C5)OC)C#N

Isomeric SMILES

CCOC(=O)C1(C(CC(C(C1C2=CC(=CC=C2)OC)C(=O)C3=CC=CC=C3)(C4=CC=CC=C4)O)C5=CC(=CC=C5)OC)C#N

InChI

InChI=1S/C37H35NO6/c1-4-44-35(40)36(24-38)31(26-15-11-19-29(21-26)42-2)23-37(41,28-17-9-6-10-18-28)33(34(39)25-13-7-5-8-14-25)32(36)27-16-12-20-30(22-27)43-3/h5-22,31-33,41H,4,23H2,1-3H3