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

Systemtic Name: ethyl 1-(4-bromophenyl)-8-nitro-4,5-dihydrobenzo[g]indazole-3-carboxylate Openeye Name: ethyl 1-(4-bromophenyl)-8-nitro-4,5-dihydrobenzo[g]indazole-3-carboxylate CAS Name: 1-(4-bromophenyl)-8-nitro-4,5-dihydrobenzo[g]indazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-bromophenyl)-8-nitro-4,5-dihydrobenzo[g]indazole-3-carboxylate Traditional Name: 1-(4-bromophenyl)-8-nitro-4,5-dihydrobenz[g]indazole-3-carboxylic acid ethyl ester Formula: C20H16BrN3O4 MolecularWeight: 442.26274

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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=C(C=C4)Br

Isomeric SMILES

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

InChI

InChI=1S/C20H16BrN3O4/c1-2-28-20(25)18-16-10-4-12-3-7-15(24(26)27)11-17(12)19(16)23(22-18)14-8-5-13(21)6-9-14/h3,5-9,11H,2,4,10H2,1H3