4-[3-[2,3-dihydro-1,4-benzodioxin-3-ylmethyl(methyl)amino]-2-oxidanyl-propoxy]benzenecarbonitrile

Systemtic Name: 4-[3-[2,3-dihydro-1,4-benzodioxin-3-ylmethyl(methyl)amino]-2-oxidanyl-propoxy]benzenecarbonitrile Openeye Name: 4-[3-[2,3-dihydro-1,4-benzodioxin-3-ylmethyl(methyl)amino]-2-hydroxy-propoxy]benzonitrile CAS Name: 4-[3-[2,3-dihydro-1,4-benzodioxin-3-ylmethyl(methyl)amino]-2-hydroxypropoxy]benzonitrile IUPAC Name: 4-[3-[2,3-dihydro-1,4-benzodioxin-3-ylmethyl(methyl)amino]-2-hydroxypropoxy]benzonitrile Traditional Name: 4-[3-[2,3-dihydro-1,4-benzodioxin-3-ylmethyl(methyl)amino]-2-hydroxy-propoxy]benzonitrile Formula: C20H22N2O4 MolecularWeight: 354.39968

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1COC2=CC=CC=C2O1)CC(COC3=CC=C(C=C3)C#N)O

Isomeric SMILES

CN(CC1COC2=CC=CC=C2O1)CC(COC3=CC=C(C=C3)C#N)O

InChI

InChI=1S/C20H22N2O4/c1-22(12-18-14-25-19-4-2-3-5-20(19)26-18)11-16(23)13-24-17-8-6-15(10-21)7-9-17/h2-9,16,18,23H,11-14H2,1H3