[3-methoxy-4-(7-methyl-6-oxidanylidene-5,7-dihydro-1H-pyrrolo[2,3-f]benzimidazol-2-yl)phenyl] methanesulfonate

Systemtic Name: [3-methoxy-4-(7-methyl-6-oxidanylidene-5,7-dihydro-1H-pyrrolo[2,3-f]benzimidazol-2-yl)phenyl] methanesulfonate Openeye Name: [3-methoxy-4-(7-methyl-6-oxo-5,7-dihydro-1H-pyrrolo[2,3-f]benzimidazol-2-yl)phenyl] methanesulfonate CAS Name: methanesulfonic acid [3-methoxy-4-(7-methyl-6-oxo-5,7-dihydro-1H-pyrrolo[2,3-f]benzimidazol-2-yl)phenyl] ester IUPAC Name: [3-methoxy-4-(7-methyl-6-oxo-5,7-dihydro-1H-pyrrolo[2,3-f]benzimidazol-2-yl)phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-(6-keto-7-methyl-5,7-dihydro-1H-pyrrolo[2,3-f]benzimidazol-2-yl)-3-methoxy-phenyl] ester Formula: C18H17N3O5S MolecularWeight: 387.40968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C2=CC3=C(C=C2NC1=O)N=C(N3)C4=C(C=C(C=C4)OS(=O)(=O)C)OC

Isomeric SMILES

CC1C2=CC3=C(C=C2NC1=O)N=C(N3)C4=C(C=C(C=C4)OS(=O)(=O)C)OC

InChI

InChI=1S/C18H17N3O5S/c1-9-12-7-14-15(8-13(12)21-18(9)22)20-17(19-14)11-5-4-10(6-16(11)25-2)26-27(3,23)24/h4-9H,1-3H3,(H,19,20)(H,21,22)