(2S,6S)-3-methanoyl-2-phenyl-6-propan-2-yl-cyclohex-3-ene-1,1-dicarbonitrile

Systemtic Name: (2S,6S)-3-methanoyl-2-phenyl-6-propan-2-yl-cyclohex-3-ene-1,1-dicarbonitrile Openeye Name: (2S,6S)-3-formyl-6-isopropyl-2-phenyl-cyclohex-3-ene-1,1-dicarbonitrile CAS Name: (2S,6S)-3-formyl-2-phenyl-6-propan-2-ylcyclohex-3-ene-1,1-dicarbonitrile IUPAC Name: (2S,6S)-3-formyl-2-phenyl-6-propan-2-ylcyclohex-3-ene-1,1-dicarbonitrile Traditional Name: (2S,6S)-3-formyl-6-isopropyl-2-phenyl-cyclohex-3-ene-1,1-dicarbonitrile Formula: C18H18N2O MolecularWeight: 278.34832

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1CC=C(C(C1(C#N)C#N)C2=CC=CC=C2)C=O

Isomeric SMILES

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

InChI

InChI=1S/C18H18N2O/c1-13(2)16-9-8-15(10-21)17(18(16,11-19)12-20)14-6-4-3-5-7-14/h3-8,10,13,16-17H,9H2,1-2H3/t16-,17+/m0/s1