ethyl 7-ethyl-2-(2-methoxy-4-methylsulfonyloxy-phenyl)-6-oxidanylidene-1,5-dihydropyrrolo[2,3-f]benzimidazole-7-carboxylate

Systemtic Name: ethyl 7-ethyl-2-(2-methoxy-4-methylsulfonyloxy-phenyl)-6-oxidanylidene-1,5-dihydropyrrolo[2,3-f]benzimidazole-7-carboxylate Openeye Name: ethyl 7-ethyl-2-(2-methoxy-4-methylsulfonyloxy-phenyl)-6-oxo-1,5-dihydropyrrolo[2,3-f]benzimidazole-7-carboxylate CAS Name: 7-ethyl-2-(2-methoxy-4-methylsulfonyloxyphenyl)-6-oxo-1,5-dihydropyrrolo[2,3-f]benzimidazole-7-carboxylic acid ethyl ester IUPAC Name: ethyl 7-ethyl-2-(2-methoxy-4-methylsulfonyloxyphenyl)-6-oxo-1,5-dihydropyrrolo[2,3-f]benzimidazole-7-carboxylate Traditional Name: 7-ethyl-6-keto-2-(2-methoxy-4-methylsulfonyloxy-phenyl)-1,5-dihydropyrrolo[2,3-f]benzimidazole-7-carboxylic acid ethyl ester Formula: C22H23N3O7S MolecularWeight: 473.49892

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C2=CC3=C(C=C2NC1=O)N=C(N3)C4=C(C=C(C=C4)OS(=O)(=O)C)OC)C(=O)OCC

Isomeric SMILES

CCC1(C2=CC3=C(C=C2NC1=O)N=C(N3)C4=C(C=C(C=C4)OS(=O)(=O)C)OC)C(=O)OCC

InChI

InChI=1S/C22H23N3O7S/c1-5-22(21(27)31-6-2)14-10-16-17(11-15(14)25-20(22)26)24-19(23-16)13-8-7-12(9-18(13)30-3)32-33(4,28)29/h7-11H,5-6H2,1-4H3,(H,23,24)(H,25,26)