[4-(7,7-dimethyl-6-oxidanylidene-1,5-dihydropyrrolo[2,3-f]benzimidazol-2-yl)-3-methoxy-phenyl] methanesulfonate

Systemtic Name: [4-(7,7-dimethyl-6-oxidanylidene-1,5-dihydropyrrolo[2,3-f]benzimidazol-2-yl)-3-methoxy-phenyl] methanesulfonate Openeye Name: [4-(7,7-dimethyl-6-oxo-1,5-dihydropyrrolo[2,3-f]benzimidazol-2-yl)-3-methoxy-phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-(7,7-dimethyl-6-oxo-1,5-dihydropyrrolo[2,3-f]benzimidazol-2-yl)-3-methoxyphenyl] ester IUPAC Name: [4-(7,7-dimethyl-6-oxo-1,5-dihydropyrrolo[2,3-f]benzimidazol-2-yl)-3-methoxyphenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-(6-keto-7,7-dimethyl-1,5-dihydropyrrolo[2,3-f]benzimidazol-2-yl)-3-methoxy-phenyl] ester Formula: C19H19N3O5S MolecularWeight: 401.43626

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC3=C(C=C2NC1=O)N=C(N3)C4=C(C=C(C=C4)OS(=O)(=O)C)OC)C

Isomeric SMILES

CC1(C2=CC3=C(C=C2NC1=O)N=C(N3)C4=C(C=C(C=C4)OS(=O)(=O)C)OC)C

InChI

InChI=1S/C19H19N3O5S/c1-19(2)12-8-14-15(9-13(12)22-18(19)23)21-17(20-14)11-6-5-10(7-16(11)26-3)27-28(4,24)25/h5-9H,1-4H3,(H,20,21)(H,22,23)