(E)-3-(2-fluoranyl-5-nitro-phenyl)-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile

Systemtic Name: (E)-3-(2-fluoranyl-5-nitro-phenyl)-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile Openeye Name: (E)-3-(2-fluoro-5-nitro-phenyl)-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile CAS Name: (E)-3-(2-fluoro-5-nitrophenyl)-2-(6-methyl-1H-benzimidazol-2-yl)-2-propenenitrile IUPAC Name: (E)-3-(2-fluoro-5-nitrophenyl)-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile Traditional Name: (E)-3-(2-fluoro-5-nitro-phenyl)-2-(6-methyl-1H-benzimidazol-2-yl)acrylonitrile Formula: C17H11FN4O2 MolecularWeight: 322.293243

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)C(=CC3=C(C=CC(=C3)[N+](=O)[O-])F)C#N

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)/C(=C/C3=C(C=CC(=C3)[N+](=O)[O-])F)/C#N

InChI

InChI=1S/C17H11FN4O2/c1-10-2-5-15-16(6-10)21-17(20-15)12(9-19)7-11-8-13(22(23)24)3-4-14(11)18/h2-8H,1H3,(H,20,21)/b12-7+