2-[3,4-dimethoxy-5-[2-methyl-6-[methyl(phenethyl)amino]hexan-3-yl]oxy-phenyl]ethanenitrile

Systemtic Name: 2-[3,4-dimethoxy-5-[2-methyl-6-[methyl(phenethyl)amino]hexan-3-yl]oxy-phenyl]ethanenitrile Openeye Name: 2-[3-[1-isopropyl-4-[methyl(phenethyl)amino]butoxy]-4,5-dimethoxy-phenyl]acetonitrile CAS Name: 2-[3,4-dimethoxy-5-[2-methyl-6-[methyl(phenethyl)amino]hexan-3-yl]oxyphenyl]acetonitrile IUPAC Name: 2-[3,4-dimethoxy-5-[2-methyl-6-[methyl(phenethyl)amino]hexan-3-yl]oxyphenyl]acetonitrile Traditional Name: 2-[3-[1-isopropyl-4-[methyl(phenethyl)amino]butoxy]-4,5-dimethoxy-phenyl]acetonitrile Formula: C26H36N2O3 MolecularWeight: 424.57564

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCN(C)CCC1=CC=CC=C1)OC2=CC(=CC(=C2OC)OC)CC#N

Isomeric SMILES

CC(C)C(CCCN(C)CCC1=CC=CC=C1)OC2=CC(=CC(=C2OC)OC)CC#N

InChI

InChI=1S/C26H36N2O3/c1-20(2)23(12-9-16-28(3)17-14-21-10-7-6-8-11-21)31-25-19-22(13-15-27)18-24(29-4)26(25)30-5/h6-8,10-11,18-20,23H,9,12-14,16-17H2,1-5H3