N-(2-methyl-5-nitro-phenyl)-2-[3-(1,2,3,4-tetrazol-1-yl)phenoxy]ethanamide

Systemtic Name: N-(2-methyl-5-nitro-phenyl)-2-[3-(1,2,3,4-tetrazol-1-yl)phenoxy]ethanamide Openeye Name: N-(2-methyl-5-nitro-phenyl)-2-[3-(tetrazol-1-yl)phenoxy]acetamide CAS Name: N-(2-methyl-5-nitrophenyl)-2-[3-(1-tetrazolyl)phenoxy]acetamide IUPAC Name: N-(2-methyl-5-nitrophenyl)-2-[3-(tetrazol-1-yl)phenoxy]acetamide Traditional Name: N-(2-methyl-5-nitro-phenyl)-2-[3-(tetrazol-1-yl)phenoxy]acetamide Formula: C16H14N6O4 MolecularWeight: 354.32016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)COC2=CC=CC(=C2)N3C=NN=N3

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)COC2=CC=CC(=C2)N3C=NN=N3

InChI

InChI=1S/C16H14N6O4/c1-11-5-6-13(22(24)25)8-15(11)18-16(23)9-26-14-4-2-3-12(7-14)21-10-17-19-20-21/h2-8,10H,9H2,1H3,(H,18,23)