N-[1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-1,2,4-triazol-3-yl]-4-nitro-benzamide

Systemtic Name: N-[1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-1,2,4-triazol-3-yl]-4-nitro-benzamide Openeye Name: N-[1-[(2-chloro-6-fluoro-phenyl)methyl]-1,2,4-triazol-3-yl]-4-nitro-benzamide CAS Name: N-[1-[(2-chloro-6-fluorophenyl)methyl]-1,2,4-triazol-3-yl]-4-nitrobenzamide IUPAC Name: N-[1-[(2-chloro-6-fluorophenyl)methyl]-1,2,4-triazol-3-yl]-4-nitrobenzamide Traditional Name: N-[1-(2-chloro-6-fluoro-benzyl)-1,2,4-triazol-3-yl]-4-nitro-benzamide Formula: C16H11ClFN5O3 MolecularWeight: 375.741643

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)CN2C=NC(=N2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])F

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)CN2C=NC(=N2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])F

InChI

InChI=1S/C16H11ClFN5O3/c17-13-2-1-3-14(18)12(13)8-22-9-19-16(21-22)20-15(24)10-4-6-11(7-5-10)23(25)26/h1-7,9H,8H2,(H,20,21,24)