(3S,5R)-3,5-bis[(diphenylmethyl)carbamoyl]-1,3,5-trimethyl-cyclohexane-1-carboxylate

Systemtic Name: (3S,5R)-3,5-bis[(diphenylmethyl)carbamoyl]-1,3,5-trimethyl-cyclohexane-1-carboxylate Openeye Name: (3S,5R)-3,5-bis(benzhydrylcarbamoyl)-1,3,5-trimethyl-cyclohexanecarboxylate CAS Name: (3S,5R)-3,5-bis[[(diphenylmethyl)amino]-oxomethyl]-1,3,5-trimethyl-1-cyclohexanecarboxylate IUPAC Name: (3S,5R)-3,5-bis(benzhydrylcarbamoyl)-1,3,5-trimethylcyclohexane-1-carboxylate Traditional Name: (3S,5R)-3,5-bis(benzhydrylcarbamoyl)-1,3,5-trimethyl-cyclohexanecarboxylate Formula: C38H39N2O4- MolecularWeight: 587.72726

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC(C1)(C)C(=O)[O-])(C)C(=O)NC(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)NC(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C[C@]1(C[C@](CC(C1)(C)C(=O)[O-])(C)C(=O)NC(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)NC(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C38H40N2O4/c1-36(33(41)39-31(27-16-8-4-9-17-27)28-18-10-5-11-19-28)24-37(2,26-38(3,25-36)35(43)44)34(42)40-32(29-20-12-6-13-21-29)30-22-14-7-15-23-30/h4-23,31-32H,24-26H2,1-3H3,(H,39,41)(H,40,42)(H,43,44)/p-1/t36-,37+,38?