ethyl 2-methyl-5-oxidanyl-6,8-diphenyl-7H-pyrrolo[2,3-e]indazole-3-carboxylate

Systemtic Name: ethyl 2-methyl-5-oxidanyl-6,8-diphenyl-7H-pyrrolo[2,3-e]indazole-3-carboxylate Openeye Name: ethyl 5-hydroxy-2-methyl-6,8-diphenyl-7H-pyrrolo[2,3-e]indazole-3-carboxylate CAS Name: 5-hydroxy-2-methyl-6,8-diphenyl-7H-pyrrolo[2,3-e]indazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-hydroxy-2-methyl-6,8-diphenyl-7H-pyrrolo[2,3-e]indazole-3-carboxylate Traditional Name: 5-hydroxy-2-methyl-6,8-diphenyl-7H-pyrrol[2,3-e]indazole-3-carboxylic acid ethyl ester Formula: C25H21N3O3 MolecularWeight: 411.45254

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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=CC=C5)O)C

Isomeric SMILES

CCOC(=O)C1=C(N=C2C1=CC(=C3C2=C(NN3C4=CC=CC=C4)C5=CC=CC=C5)O)C

InChI

InChI=1S/C25H21N3O3/c1-3-31-25(30)20-15(2)26-23-18(20)14-19(29)24-21(23)22(16-10-6-4-7-11-16)27-28(24)17-12-8-5-9-13-17/h4-14,27,29H,3H2,1-2H3