(E)-2-(benzotriazol-1-yl)-3-(3-nitrophenyl)prop-2-enenitrile

Systemtic Name: (E)-2-(benzotriazol-1-yl)-3-(3-nitrophenyl)prop-2-enenitrile Openeye Name: (E)-2-(benzotriazol-1-yl)-3-(3-nitrophenyl)prop-2-enenitrile CAS Name: (E)-2-(1-benzotriazolyl)-3-(3-nitrophenyl)-2-propenenitrile IUPAC Name: (E)-2-(benzotriazol-1-yl)-3-(3-nitrophenyl)prop-2-enenitrile Traditional Name: (E)-2-(benzotriazol-1-yl)-3-(3-nitrophenyl)acrylonitrile Formula: C15H9N5O2 MolecularWeight: 291.26426

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2C(=CC3=CC(=CC=C3)[N+](=O)[O-])C#N

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2/C(=C/C3=CC(=CC=C3)[N+](=O)[O-])/C#N

InChI

InChI=1S/C15H9N5O2/c16-10-13(9-11-4-3-5-12(8-11)20(21)22)19-15-7-2-1-6-14(15)17-18-19/h1-9H/b13-9+