[2-[(2-bromanyl-4-nitro-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 1H-indazole-5-carboxylate

Systemtic Name: [2-[(2-bromanyl-4-nitro-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 1H-indazole-5-carboxylate Openeye Name: [2-(2-bromo-4-nitro-anilino)-2-oxo-1-phenyl-ethyl] 1H-indazole-5-carboxylate CAS Name: 1H-indazole-5-carboxylic acid [2-(2-bromo-4-nitroanilino)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(2-bromo-4-nitroanilino)-2-oxo-1-phenylethyl] 1H-indazole-5-carboxylate Traditional Name: 1H-indazole-5-carboxylic acid [2-(2-bromo-4-nitro-anilino)-2-keto-1-phenyl-ethyl] ester Formula: C22H15BrN4O5 MolecularWeight: 495.2823

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Br)OC(=O)C3=CC4=C(C=C3)NN=C4

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Br)OC(=O)C3=CC4=C(C=C3)NN=C4

InChI

InChI=1S/C22H15BrN4O5/c23-17-11-16(27(30)31)7-9-19(17)25-21(28)20(13-4-2-1-3-5-13)32-22(29)14-6-8-18-15(10-14)12-24-26-18/h1-12,20H,(H,24,26)(H,25,28)