methyl (1S,4Z,6S)-2-oxidanylidene-6-phenyl-4-(phenylhydrazinylidene)cyclohexane-1-carboxylate

Systemtic Name: methyl (1S,4Z,6S)-2-oxidanylidene-6-phenyl-4-(phenylhydrazinylidene)cyclohexane-1-carboxylate Openeye Name: methyl (1S,4Z,6S)-2-oxo-6-phenyl-4-(phenylhydrazono)cyclohexanecarboxylate CAS Name: (1S,4Z,6S)-2-oxo-6-phenyl-4-(phenylhydrazinylidene)-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl (1S,4Z,6S)-2-oxo-6-phenyl-4-(phenylhydrazinylidene)cyclohexane-1-carboxylate Traditional Name: (1S,4Z,6S)-2-keto-6-phenyl-4-(phenylhydrazono)cyclohexanecarboxylic acid methyl ester Formula: C20H20N2O3 MolecularWeight: 336.3844

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(CC(=NNC2=CC=CC=C2)CC1=O)C3=CC=CC=C3

Isomeric SMILES

COC(=O)[C@H]1[C@H](C/C(=N/NC2=CC=CC=C2)/CC1=O)C3=CC=CC=C3

InChI

InChI=1S/C20H20N2O3/c1-25-20(24)19-17(14-8-4-2-5-9-14)12-16(13-18(19)23)22-21-15-10-6-3-7-11-15/h2-11,17,19,21H,12-13H2,1H3/b22-16-/t17-,19+/m1/s1