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

Systemtic Name: N-(2-bromanyl-4-methyl-phenyl)-2-[5-(4-nitrophenyl)-1,2,3,4-tetrazol-2-yl]ethanamide Openeye Name: N-(2-bromo-4-methyl-phenyl)-2-[5-(4-nitrophenyl)tetrazol-2-yl]acetamide CAS Name: N-(2-bromo-4-methylphenyl)-2-[5-(4-nitrophenyl)-2-tetrazolyl]acetamide IUPAC Name: N-(2-bromo-4-methylphenyl)-2-[5-(4-nitrophenyl)tetrazol-2-yl]acetamide Traditional Name: N-(2-bromo-4-methyl-phenyl)-2-[5-(4-nitrophenyl)tetrazol-2-yl]acetamide Formula: C16H13BrN6O3 MolecularWeight: 417.21682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CN2N=C(N=N2)C3=CC=C(C=C3)[N+](=O)[O-])Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CN2N=C(N=N2)C3=CC=C(C=C3)[N+](=O)[O-])Br

InChI

InChI=1S/C16H13BrN6O3/c1-10-2-7-14(13(17)8-10)18-15(24)9-22-20-16(19-21-22)11-3-5-12(6-4-11)23(25)26/h2-8H,9H2,1H3,(H,18,24)