ethyl 2-methyl-8-(4-nitrophenyl)-5-oxidanyl-6-phenyl-7H-pyrrolo[2,3-e]indazole-3-carboxylate

Systemtic Name: ethyl 2-methyl-8-(4-nitrophenyl)-5-oxidanyl-6-phenyl-7H-pyrrolo[2,3-e]indazole-3-carboxylate Openeye Name: ethyl 5-hydroxy-2-methyl-8-(4-nitrophenyl)-6-phenyl-7H-pyrrolo[2,3-e]indazole-3-carboxylate CAS Name: 5-hydroxy-2-methyl-8-(4-nitrophenyl)-6-phenyl-7H-pyrrolo[2,3-e]indazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-hydroxy-2-methyl-8-(4-nitrophenyl)-6-phenyl-7H-pyrrolo[2,3-e]indazole-3-carboxylate Traditional Name: 5-hydroxy-2-methyl-8-(4-nitrophenyl)-6-phenyl-7H-pyrrol[2,3-e]indazole-3-carboxylic acid ethyl ester Formula: C25H20N4O5 MolecularWeight: 456.4501

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C2C1=CC(=C3C2=C(NN3C4=CC=CC=C4)C5=CC=C(C=C5)[N+](=O)[O-])O)C

Isomeric SMILES

CCOC(=O)C1=C(N=C2C1=CC(=C3C2=C(NN3C4=CC=CC=C4)C5=CC=C(C=C5)[N+](=O)[O-])O)C

InChI

InChI=1S/C25H20N4O5/c1-3-34-25(31)20-14(2)26-23-18(20)13-19(30)24-21(23)22(15-9-11-17(12-10-15)29(32)33)27-28(24)16-7-5-4-6-8-16/h4-13,27,30H,3H2,1-2H3