3-[1-(1,3-benzodioxol-5-yl)ethylamino]benzenecarbonitrile

Systemtic Name: 3-[1-(1,3-benzodioxol-5-yl)ethylamino]benzenecarbonitrile Openeye Name: 3-[1-(1,3-benzodioxol-5-yl)ethylamino]benzonitrile CAS Name: 3-[1-(1,3-benzodioxol-5-yl)ethylamino]benzonitrile IUPAC Name: 3-[1-(1,3-benzodioxol-5-yl)ethylamino]benzonitrile Traditional Name: 3-[1-(1,3-benzodioxol-5-yl)ethylamino]benzonitrile Formula: C16H14N2O2 MolecularWeight: 266.29456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCO2)NC3=CC=CC(=C3)C#N

Isomeric SMILES

CC(C1=CC2=C(C=C1)OCO2)NC3=CC=CC(=C3)C#N

InChI

InChI=1S/C16H14N2O2/c1-11(18-14-4-2-3-12(7-14)9-17)13-5-6-15-16(8-13)20-10-19-15/h2-8,11,18H,10H2,1H3