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

Systemtic Name: N-(4-chloranyl-2-methyl-phenyl)-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Openeye Name: N-(4-chloro-2-methyl-phenyl)-3-nitro-4-(1,2,4-triazol-1-yl)benzamide CAS Name: N-(4-chloro-2-methylphenyl)-3-nitro-4-(1,2,4-triazol-1-yl)benzamide IUPAC Name: N-(4-chloro-2-methylphenyl)-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Traditional Name: N-(4-chloro-2-methyl-phenyl)-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Formula: C16H12ClN5O3 MolecularWeight: 357.75118

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12ClN5O3/c1-10-6-12(17)3-4-13(10)20-16(23)11-2-5-14(15(7-11)22(24)25)21-9-18-8-19-21/h2-9H,1H3,(H,20,23)