2-[3-[[(1S,6R)-6-methyl-3,4-diphenyl-cyclohex-3-en-1-yl]methyl]pentan-3-yl]propanedinitrile

Systemtic Name: 2-[3-[[(1S,6R)-6-methyl-3,4-diphenyl-cyclohex-3-en-1-yl]methyl]pentan-3-yl]propanedinitrile Openeye Name: 2-[1-ethyl-1-[[(1S,6R)-6-methyl-3,4-diphenyl-cyclohex-3-en-1-yl]methyl]propyl]propanedinitrile CAS Name: 2-[3-[[(1S,6R)-6-methyl-3,4-diphenyl-1-cyclohex-3-enyl]methyl]pentan-3-yl]propanedinitrile IUPAC Name: 2-[3-[[(1S,6R)-6-methyl-3,4-diphenylcyclohex-3-en-1-yl]methyl]pentan-3-yl]propanedinitrile Traditional Name: 2-[1-ethyl-1-[[(1S,6R)-6-methyl-3,4-diphenyl-cyclohex-3-en-1-yl]methyl]propyl]malononitrile Formula: C28H32N2 MolecularWeight: 396.56708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(CC1CC(=C(CC1C)C2=CC=CC=C2)C3=CC=CC=C3)C(C#N)C#N

Isomeric SMILES

CCC(CC)(C[C@H]1CC(=C(C[C@H]1C)C2=CC=CC=C2)C3=CC=CC=C3)C(C#N)C#N

InChI

InChI=1S/C28H32N2/c1-4-28(5-2,25(19-29)20-30)18-24-17-27(23-14-10-7-11-15-23)26(16-21(24)3)22-12-8-6-9-13-22/h6-15,21,24-25H,4-5,16-18H2,1-3H3/t21-,24-/m1/s1