(E)-3-(1,3-benzodioxol-5-yl)-2-(benzotriazol-1-yl)prop-2-enenitrile

Systemtic Name: (E)-3-(1,3-benzodioxol-5-yl)-2-(benzotriazol-1-yl)prop-2-enenitrile Openeye Name: (E)-3-(1,3-benzodioxol-5-yl)-2-(benzotriazol-1-yl)prop-2-enenitrile CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-2-(1-benzotriazolyl)-2-propenenitrile IUPAC Name: (E)-3-(1,3-benzodioxol-5-yl)-2-(benzotriazol-1-yl)prop-2-enenitrile Traditional Name: (E)-3-(1,3-benzodioxol-5-yl)-2-(benzotriazol-1-yl)acrylonitrile Formula: C16H10N4O2 MolecularWeight: 290.2762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=C(C#N)N3C4=CC=CC=C4N=N3

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=C(\C#N)/N3C4=CC=CC=C4N=N3

InChI

InChI=1S/C16H10N4O2/c17-9-12(20-14-4-2-1-3-13(14)18-19-20)7-11-5-6-15-16(8-11)22-10-21-15/h1-8H,10H2/b12-7+