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

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

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1C2=CC(=CC=C2)NC(=O)C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CN1C=NN=C1C2=CC(=CC=C2)NC(=O)C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

InChI

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