(E)-2-(benzotriazol-2-yl)-3-[4-(trifluoromethyl)phenyl]prop-2-enenitrile

Systemtic Name: (E)-2-(benzotriazol-2-yl)-3-[4-(trifluoromethyl)phenyl]prop-2-enenitrile Openeye Name: (E)-2-(benzotriazol-2-yl)-3-[4-(trifluoromethyl)phenyl]prop-2-enenitrile CAS Name: (E)-2-(2-benzotriazolyl)-3-[4-(trifluoromethyl)phenyl]-2-propenenitrile IUPAC Name: (E)-2-(benzotriazol-2-yl)-3-[4-(trifluoromethyl)phenyl]prop-2-enenitrile Traditional Name: (E)-2-(benzotriazol-2-yl)-3-[4-(trifluoromethyl)phenyl]acrylonitrile Formula: C16H9F3N4 MolecularWeight: 314.26467

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NN(N=C2C=C1)C(=CC3=CC=C(C=C3)C(F)(F)F)C#N

Isomeric SMILES

C1=CC2=NN(N=C2C=C1)/C(=C/C3=CC=C(C=C3)C(F)(F)F)/C#N

InChI

InChI=1S/C16H9F3N4/c17-16(18,19)12-7-5-11(6-8-12)9-13(10-20)23-21-14-3-1-2-4-15(14)22-23/h1-9H/b13-9+