ethyl (1S,2R,5S)-6-azanylidene-1,5-dicyano-2,4-diphenyl-cyclohex-3-ene-1-carboxylate

Systemtic Name: ethyl (1S,2R,5S)-6-azanylidene-1,5-dicyano-2,4-diphenyl-cyclohex-3-ene-1-carboxylate Openeye Name: ethyl (1S,2R,5S)-1,5-dicyano-6-imino-2,4-diphenyl-cyclohex-3-ene-1-carboxylate CAS Name: (1S,2R,5S)-1,5-dicyano-6-imino-2,4-diphenyl-1-cyclohex-3-enecarboxylic acid ethyl ester IUPAC Name: ethyl (1S,2R,5S)-1,5-dicyano-6-imino-2,4-diphenylcyclohex-3-ene-1-carboxylate Traditional Name: (1S,2R,5S)-1,5-dicyano-6-imino-2,4-diphenyl-cyclohex-3-ene-1-carboxylic acid ethyl ester Formula: C23H19N3O2 MolecularWeight: 369.41586

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C(C=C(C(C1=N)C#N)C2=CC=CC=C2)C3=CC=CC=C3)C#N

Isomeric SMILES

CCOC(=O)[C@]1([C@H](C=C([C@@H](C1=N)C#N)C2=CC=CC=C2)C3=CC=CC=C3)C#N

InChI

InChI=1S/C23H19N3O2/c1-2-28-22(27)23(15-25)20(17-11-7-4-8-12-17)13-18(19(14-24)21(23)26)16-9-5-3-6-10-16/h3-13,19-20,26H,2H2,1H3/t19-,20+,23-/m0/s1