2-[4-(cyanomethyl)-2-(3,7-dimethyloctoxy)-5-methoxy-phenyl]ethanenitrile

Systemtic Name: 2-[4-(cyanomethyl)-2-(3,7-dimethyloctoxy)-5-methoxy-phenyl]ethanenitrile Openeye Name: 2-[4-(cyanomethyl)-2-(3,7-dimethyloctoxy)-5-methoxy-phenyl]acetonitrile CAS Name: 2-[4-(cyanomethyl)-2-(3,7-dimethyloctoxy)-5-methoxyphenyl]acetonitrile IUPAC Name: 2-[4-(cyanomethyl)-2-(3,7-dimethyloctoxy)-5-methoxyphenyl]acetonitrile Traditional Name: 2-[4-(cyanomethyl)-2-(3,7-dimethyloctoxy)-5-methoxy-phenyl]acetonitrile Formula: C21H30N2O2 MolecularWeight: 342.4751

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)CCOC1=CC(=C(C=C1CC#N)OC)CC#N

Isomeric SMILES

CC(C)CCCC(C)CCOC1=CC(=C(C=C1CC#N)OC)CC#N

InChI

InChI=1S/C21H30N2O2/c1-16(2)6-5-7-17(3)10-13-25-21-15-18(8-11-22)20(24-4)14-19(21)9-12-23/h14-17H,5-10,13H2,1-4H3