3,4-bis[(3R)-3,7-dimethyloct-6-enoxy]benzenecarbonitrile

Systemtic Name: 3,4-bis[(3R)-3,7-dimethyloct-6-enoxy]benzenecarbonitrile Openeye Name: 3,4-bis[(3R)-3,7-dimethyloct-6-enoxy]benzonitrile CAS Name: 3,4-bis[(3R)-3,7-dimethyloct-6-enoxy]benzonitrile IUPAC Name: 3,4-bis[(3R)-3,7-dimethyloct-6-enoxy]benzonitrile Traditional Name: 3,4-bis[(3R)-3,7-dimethyloct-6-enoxy]benzonitrile Formula: C27H41NO2 MolecularWeight: 411.61994

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC=C(C)C)CCOC1=C(C=C(C=C1)C#N)OCCC(C)CCC=C(C)C

Isomeric SMILES

C[C@H](CCC=C(C)C)CCOC1=C(C=C(C=C1)C#N)OCC[C@H](C)CCC=C(C)C

InChI

InChI=1S/C27H41NO2/c1-21(2)9-7-11-23(5)15-17-29-26-14-13-25(20-28)19-27(26)30-18-16-24(6)12-8-10-22(3)4/h9-10,13-14,19,23-24H,7-8,11-12,15-18H2,1-6H3/t23-,24-/m1/s1