(E)-2-(5-methyl-1H-1,2,4-triazol-3-yl)-3-(2-nitrophenyl)prop-2-enenitrile

Systemtic Name: (E)-2-(5-methyl-1H-1,2,4-triazol-3-yl)-3-(2-nitrophenyl)prop-2-enenitrile Openeye Name: (E)-2-(5-methyl-1H-1,2,4-triazol-3-yl)-3-(2-nitrophenyl)prop-2-enenitrile CAS Name: (E)-2-(5-methyl-1H-1,2,4-triazol-3-yl)-3-(2-nitrophenyl)-2-propenenitrile IUPAC Name: (E)-2-(5-methyl-1H-1,2,4-triazol-3-yl)-3-(2-nitrophenyl)prop-2-enenitrile Traditional Name: (E)-2-(5-methyl-1H-1,2,4-triazol-3-yl)-3-(2-nitrophenyl)acrylonitrile Formula: C12H9N5O2 MolecularWeight: 255.23216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NN1)C(=CC2=CC=CC=C2[N+](=O)[O-])C#N

Isomeric SMILES

CC1=NC(=NN1)/C(=C/C2=CC=CC=C2[N+](=O)[O-])/C#N

InChI

InChI=1S/C12H9N5O2/c1-8-14-12(16-15-8)10(7-13)6-9-4-2-3-5-11(9)17(18)19/h2-6H,1H3,(H,14,15,16)/b10-6+