ethyl 8-nitro-1-(3-sulfamoylphenyl)-4,5-dihydrobenzo[g]indazole-3-carboxylate

Systemtic Name: ethyl 8-nitro-1-(3-sulfamoylphenyl)-4,5-dihydrobenzo[g]indazole-3-carboxylate Openeye Name: ethyl 8-nitro-1-(3-sulfamoylphenyl)-4,5-dihydrobenzo[g]indazole-3-carboxylate CAS Name: 8-nitro-1-(3-sulfamoylphenyl)-4,5-dihydrobenzo[g]indazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 8-nitro-1-(3-sulfamoylphenyl)-4,5-dihydrobenzo[g]indazole-3-carboxylate Traditional Name: 8-nitro-1-(3-sulfamoylphenyl)-4,5-dihydrobenz[g]indazole-3-carboxylic acid ethyl ester Formula: C20H18N4O6S MolecularWeight: 442.44512

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C2=C1CCC3=C2C=C(C=C3)[N+](=O)[O-])C4=CC(=CC=C4)S(=O)(=O)N

Isomeric SMILES

CCOC(=O)C1=NN(C2=C1CCC3=C2C=C(C=C3)[N+](=O)[O-])C4=CC(=CC=C4)S(=O)(=O)N

InChI

InChI=1S/C20H18N4O6S/c1-2-30-20(25)18-16-9-7-12-6-8-14(24(26)27)11-17(12)19(16)23(22-18)13-4-3-5-15(10-13)31(21,28)29/h3-6,8,10-11H,2,7,9H2,1H3,(H2,21,28,29)