2-(2-azanylbutan-2-yl)-3-[2-[methyl-(phenylmethyl)amino]ethoxy]benzenecarbonitrile

Systemtic Name: 2-(2-azanylbutan-2-yl)-3-[2-[methyl-(phenylmethyl)amino]ethoxy]benzenecarbonitrile Openeye Name: 2-(1-amino-1-methyl-propyl)-3-[2-[benzyl(methyl)amino]ethoxy]benzonitrile CAS Name: 2-(2-aminobutan-2-yl)-3-[2-[methyl-(phenylmethyl)amino]ethoxy]benzonitrile IUPAC Name: 2-(2-aminobutan-2-yl)-3-[2-[benzyl(methyl)amino]ethoxy]benzonitrile Traditional Name: 2-(1-amino-1-methyl-propyl)-3-[2-[benzyl(methyl)amino]ethoxy]benzonitrile Formula: C21H27N3O MolecularWeight: 337.45858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C1=C(C=CC=C1OCCN(C)CC2=CC=CC=C2)C#N)N

Isomeric SMILES

CCC(C)(C1=C(C=CC=C1OCCN(C)CC2=CC=CC=C2)C#N)N

InChI

InChI=1S/C21H27N3O/c1-4-21(2,23)20-18(15-22)11-8-12-19(20)25-14-13-24(3)16-17-9-6-5-7-10-17/h5-12H,4,13-14,16,23H2,1-3H3