2-[4-[(2R)-3-[(4,5-dimethoxy-2-methyl-phenyl)methyl-methyl-amino]-2-oxidanyl-propoxy]phenyl]ethanenitrile

Systemtic Name: 2-[4-[(2R)-3-[(4,5-dimethoxy-2-methyl-phenyl)methyl-methyl-amino]-2-oxidanyl-propoxy]phenyl]ethanenitrile Openeye Name: 2-[4-[(2R)-3-[(4,5-dimethoxy-2-methyl-phenyl)methyl-methyl-amino]-2-hydroxy-propoxy]phenyl]acetonitrile CAS Name: 2-[4-[(2R)-3-[(4,5-dimethoxy-2-methylphenyl)methyl-methylamino]-2-hydroxypropoxy]phenyl]acetonitrile IUPAC Name: 2-[4-[(2R)-3-[(4,5-dimethoxy-2-methylphenyl)methyl-methylamino]-2-hydroxypropoxy]phenyl]acetonitrile Traditional Name: 2-[4-[(2R)-3-[(4,5-dimethoxy-2-methyl-benzyl)-methyl-amino]-2-hydroxy-propoxy]phenyl]acetonitrile Formula: C22H28N2O4 MolecularWeight: 384.46872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1CN(C)CC(COC2=CC=C(C=C2)CC#N)O)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1CN(C)C[C@H](COC2=CC=C(C=C2)CC#N)O)OC)OC

InChI

InChI=1S/C22H28N2O4/c1-16-11-21(26-3)22(27-4)12-18(16)13-24(2)14-19(25)15-28-20-7-5-17(6-8-20)9-10-23/h5-8,11-12,19,25H,9,13-15H2,1-4H3/t19-/m1/s1