N-(3-fluoranyl-4-methyl-phenyl)-3-nitro-4-(1,2,4-triazol-1-yl)benzamide

Systemtic Name: N-(3-fluoranyl-4-methyl-phenyl)-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Openeye Name: N-(3-fluoro-4-methyl-phenyl)-3-nitro-4-(1,2,4-triazol-1-yl)benzamide CAS Name: N-(3-fluoro-4-methylphenyl)-3-nitro-4-(1,2,4-triazol-1-yl)benzamide IUPAC Name: N-(3-fluoro-4-methylphenyl)-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Traditional Name: N-(3-fluoro-4-methyl-phenyl)-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Formula: C16H12FN5O3 MolecularWeight: 341.296583

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC(=C(C=C2)N3C=NC=N3)[N+](=O)[O-])F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=C(C=C2)N3C=NC=N3)[N+](=O)[O-])F

InChI

InChI=1S/C16H12FN5O3/c1-10-2-4-12(7-13(10)17)20-16(23)11-3-5-14(15(6-11)22(24)25)21-9-18-8-19-21/h2-9H,1H3,(H,20,23)