(2-methyl-5-nitro-phenyl) 2-bromanyl-4-chloranyl-5-phenyl-imidazole-1-sulfinate

Systemtic Name: (2-methyl-5-nitro-phenyl) 2-bromanyl-4-chloranyl-5-phenyl-imidazole-1-sulfinate Openeye Name: (2-methyl-5-nitro-phenyl) 2-bromo-4-chloro-5-phenyl-imidazole-1-sulfinate CAS Name: 2-bromo-4-chloro-5-phenyl-1-imidazolesulfinic acid (2-methyl-5-nitrophenyl) ester IUPAC Name: (2-methyl-5-nitrophenyl) 2-bromo-4-chloro-5-phenylimidazole-1-sulfinate Traditional Name: 2-bromo-4-chloro-5-phenyl-imidazole-1-sulfinic acid (2-methyl-5-nitro-phenyl) ester Formula: C16H11BrClN3O4S MolecularWeight: 456.69824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])OS(=O)N2C(=C(N=C2Br)Cl)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])OS(=O)N2C(=C(N=C2Br)Cl)C3=CC=CC=C3

InChI

InChI=1S/C16H11BrClN3O4S/c1-10-7-8-12(21(22)23)9-13(10)25-26(24)20-14(15(18)19-16(20)17)11-5-3-2-4-6-11/h2-9H,1H3