2-[4-[3-[(3-fluoranyl-4-methoxy-phenyl)methyl-methyl-amino]-2-oxidanyl-propoxy]phenyl]ethanenitrile

Systemtic Name: 2-[4-[3-[(3-fluoranyl-4-methoxy-phenyl)methyl-methyl-amino]-2-oxidanyl-propoxy]phenyl]ethanenitrile Openeye Name: 2-[4-[3-[(3-fluoro-4-methoxy-phenyl)methyl-methyl-amino]-2-hydroxy-propoxy]phenyl]acetonitrile CAS Name: 2-[4-[3-[(3-fluoro-4-methoxyphenyl)methyl-methylamino]-2-hydroxypropoxy]phenyl]acetonitrile IUPAC Name: 2-[4-[3-[(3-fluoro-4-methoxyphenyl)methyl-methylamino]-2-hydroxypropoxy]phenyl]acetonitrile Traditional Name: 2-[4-[3-[(3-fluoro-4-methoxy-benzyl)-methyl-amino]-2-hydroxy-propoxy]phenyl]acetonitrile Formula: C20H23FN2O3 MolecularWeight: 358.406623

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=C(C=C1)OC)F)CC(COC2=CC=C(C=C2)CC#N)O

Isomeric SMILES

CN(CC1=CC(=C(C=C1)OC)F)CC(COC2=CC=C(C=C2)CC#N)O

InChI

InChI=1S/C20H23FN2O3/c1-23(12-16-5-8-20(25-2)19(21)11-16)13-17(24)14-26-18-6-3-15(4-7-18)9-10-22/h3-8,11,17,24H,9,12-14H2,1-2H3