ethyl 1-(3-bromophenyl)-4-(3-nitrophenyl)sulfonyloxy-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: ethyl 1-(3-bromophenyl)-4-(3-nitrophenyl)sulfonyloxy-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: ethyl 1-(3-bromophenyl)-4-(3-nitrophenyl)sulfonyloxy-6-oxo-pyridazine-3-carboxylate CAS Name: 1-(3-bromophenyl)-4-(3-nitrophenyl)sulfonyloxy-6-oxo-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(3-bromophenyl)-4-(3-nitrophenyl)sulfonyloxy-6-oxopyridazine-3-carboxylate Traditional Name: 1-(3-bromophenyl)-6-keto-4-(3-nitrophenyl)sulfonyloxy-pyridazine-3-carboxylic acid ethyl ester Formula: C19H14BrN3O8S MolecularWeight: 524.29876

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C=C1OS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])C3=CC(=CC=C3)Br

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C=C1OS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])C3=CC(=CC=C3)Br

InChI

InChI=1S/C19H14BrN3O8S/c1-2-30-19(25)18-16(11-17(24)22(21-18)13-6-3-5-12(20)9-13)31-32(28,29)15-8-4-7-14(10-15)23(26)27/h3-11H,2H2,1H3