ditert-butyl (6E)-4-methyl-6-[(4-methylphenyl)sulfonylhydrazinylidene]-4-oxidanyl-2-phenyl-cyclohexane-1,3-dicarboxylate

Systemtic Name: ditert-butyl (6E)-4-methyl-6-[(4-methylphenyl)sulfonylhydrazinylidene]-4-oxidanyl-2-phenyl-cyclohexane-1,3-dicarboxylate Openeye Name: ditert-butyl (6E)-4-hydroxy-4-methyl-2-phenyl-6-(p-tolylsulfonylhydrazono)cyclohexane-1,3-dicarboxylate CAS Name: (6E)-4-hydroxy-4-methyl-6-[(4-methylphenyl)sulfonylhydrazinylidene]-2-phenylcyclohexane-1,3-dicarboxylic acid ditert-butyl ester IUPAC Name: ditert-butyl (6E)-4-hydroxy-4-methyl-6-[(4-methylphenyl)sulfonylhydrazinylidene]-2-phenylcyclohexane-1,3-dicarboxylate Traditional Name: (6E)-4-hydroxy-4-methyl-2-phenyl-6-(tosylhydrazono)cyclohexane-1,3-dicarboxylic acid ditert-butyl ester Formula: C30H40N2O7S MolecularWeight: 572.7128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NN=C2CC(C(C(C2C(=O)OC(C)(C)C)C3=CC=CC=C3)C(=O)OC(C)(C)C)(C)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N/N=C/2\CC(C(C(C2C(=O)OC(C)(C)C)C3=CC=CC=C3)C(=O)OC(C)(C)C)(C)O

InChI

InChI=1S/C30H40N2O7S/c1-19-14-16-21(17-15-19)40(36,37)32-31-22-18-30(8,35)25(27(34)39-29(5,6)7)23(20-12-10-9-11-13-20)24(22)26(33)38-28(2,3)4/h9-17,23-25,32,35H,18H2,1-8H3/b31-22+