bis(prop-2-enyl) (2S,3S,4S)-2-(4-chlorophenyl)-4-methyl-4-oxidanyl-6-phenethylimino-cyclohexane-1,3-dicarboxylate

Systemtic Name: bis(prop-2-enyl) (2S,3S,4S)-2-(4-chlorophenyl)-4-methyl-4-oxidanyl-6-phenethylimino-cyclohexane-1,3-dicarboxylate Openeye Name: diallyl (2S,3S,4S)-2-(4-chlorophenyl)-4-hydroxy-4-methyl-6-phenethylimino-cyclohexane-1,3-dicarboxylate CAS Name: (2S,3S,4S)-2-(4-chlorophenyl)-4-hydroxy-4-methyl-6-phenethyliminocyclohexane-1,3-dicarboxylic acid bis(prop-2-enyl) ester IUPAC Name: bis(prop-2-enyl) (2S,3S,4S)-2-(4-chlorophenyl)-4-hydroxy-4-methyl-6-phenethyliminocyclohexane-1,3-dicarboxylate Traditional Name: (2S,3S,4S)-2-(4-chlorophenyl)-4-hydroxy-4-methyl-6-phenethylimino-cyclohexane-1,3-dicarboxylic acid diallyl ester Formula: C29H32ClNO5 MolecularWeight: 510.02108

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=NCCC2=CC=CC=C2)C(C(C1C(=O)OCC=C)C3=CC=C(C=C3)Cl)C(=O)OCC=C)O

Isomeric SMILES

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

InChI

InChI=1S/C29H32ClNO5/c1-4-17-35-27(32)25-23(31-16-15-20-9-7-6-8-10-20)19-29(3,34)26(28(33)36-18-5-2)24(25)21-11-13-22(30)14-12-21/h4-14,24-26,34H,1-2,15-19H2,3H3/t24-,25?,26+,29-/m0/s1