1-[4-bromanyl-2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]-3-(4-methyl-3-nitro-phenyl)urea

Systemtic Name: 1-[4-bromanyl-2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]-3-(4-methyl-3-nitro-phenyl)urea Openeye Name: 1-[4-bromo-2-(2H-tetrazol-5-yl)phenyl]-3-(4-methyl-3-nitro-phenyl)urea CAS Name: 1-[4-bromo-2-(2H-tetrazol-5-yl)phenyl]-3-(4-methyl-3-nitrophenyl)urea IUPAC Name: 1-[4-bromo-2-(2H-tetrazol-5-yl)phenyl]-3-(4-methyl-3-nitrophenyl)urea Traditional Name: 1-[4-bromo-2-(2H-tetrazol-5-yl)phenyl]-3-(4-methyl-3-nitro-phenyl)urea Formula: C15H12BrN7O3 MolecularWeight: 418.20488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)NC2=C(C=C(C=C2)Br)C3=NNN=N3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)NC2=C(C=C(C=C2)Br)C3=NNN=N3)[N+](=O)[O-]

InChI

InChI=1S/C15H12BrN7O3/c1-8-2-4-10(7-13(8)23(25)26)17-15(24)18-12-5-3-9(16)6-11(12)14-19-21-22-20-14/h2-7H,1H3,(H2,17,18,24)(H,19,20,21,22)