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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NC2=NN(C=N2)CC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NC2=NN(C=N2)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H12ClN5O3/c17-13-6-4-11(5-7-13)9-21-10-18-16(20-21)19-15(23)12-2-1-3-14(8-12)22(24)25/h1-8,10H,9H2,(H,19,20,23)