dimethyl (2R,3S,4R)-4-methyl-4-oxidanyl-6-phenethylimino-2-phenyl-cyclohexane-1,3-dicarboxylate

Systemtic Name: dimethyl (2R,3S,4R)-4-methyl-4-oxidanyl-6-phenethylimino-2-phenyl-cyclohexane-1,3-dicarboxylate Openeye Name: dimethyl (2R,3S,4R)-4-hydroxy-4-methyl-6-phenethylimino-2-phenyl-cyclohexane-1,3-dicarboxylate CAS Name: (2R,3S,4R)-4-hydroxy-4-methyl-6-phenethylimino-2-phenylcyclohexane-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (2R,3S,4R)-4-hydroxy-4-methyl-6-phenethylimino-2-phenylcyclohexane-1,3-dicarboxylate Traditional Name: (2R,3S,4R)-4-hydroxy-4-methyl-6-phenethylimino-2-phenyl-cyclohexane-1,3-dicarboxylic acid dimethyl ester Formula: C25H29NO5 MolecularWeight: 423.50146

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=NCCC2=CC=CC=C2)C(C(C1C(=O)OC)C3=CC=CC=C3)C(=O)OC)O

Isomeric SMILES

C[C@]1(CC(=NCCC2=CC=CC=C2)C([C@H]([C@@H]1C(=O)OC)C3=CC=CC=C3)C(=O)OC)O

InChI

InChI=1S/C25H29NO5/c1-25(29)16-19(26-15-14-17-10-6-4-7-11-17)21(23(27)30-2)20(22(25)24(28)31-3)18-12-8-5-9-13-18/h4-13,20-22,29H,14-16H2,1-3H3/t20-,21?,22-,25-/m1/s1