2-[4-[[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-methyl-amino]methyl]phenyl]benzenecarbonitrile

Systemtic Name: 2-[4-[[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-methyl-amino]methyl]phenyl]benzenecarbonitrile Openeye Name: 2-[4-[[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-methyl-amino]methyl]phenyl]benzonitrile CAS Name: 2-[4-[[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-methylamino]methyl]phenyl]benzonitrile IUPAC Name: 2-[4-[[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-methylamino]methyl]phenyl]benzonitrile Traditional Name: 2-[4-[[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-methyl-amino]methyl]phenyl]benzonitrile Formula: C24H22N2O2 MolecularWeight: 370.44368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1COC2=CC=CC=C2O1)CC3=CC=C(C=C3)C4=CC=CC=C4C#N

Isomeric SMILES

CN(C[C@H]1COC2=CC=CC=C2O1)CC3=CC=C(C=C3)C4=CC=CC=C4C#N

InChI

InChI=1S/C24H22N2O2/c1-26(16-21-17-27-23-8-4-5-9-24(23)28-21)15-18-10-12-19(13-11-18)22-7-3-2-6-20(22)14-25/h2-13,21H,15-17H2,1H3/t21-/m0/s1