N-(3-bromophenyl)-6,7-dimethoxy-3,4-dihydroimidazo[1,2-a]indol-9-ium-1-sulfonamide

Systemtic Name: N-(3-bromophenyl)-6,7-dimethoxy-3,4-dihydroimidazo[1,2-a]indol-9-ium-1-sulfonamide Openeye Name: N-(3-bromophenyl)-6,7-dimethoxy-3,4-dihydroimidazo[1,2-a]indol-9-ium-1-sulfonamide CAS Name: N-(3-bromophenyl)-6,7-dimethoxy-3,4-dihydroimidazo[1,2-a]indol-9-ium-1-sulfonamide IUPAC Name: N-(3-bromophenyl)-6,7-dimethoxy-3,4-dihydroimidazo[1,2-a]indol-9-ium-1-sulfonamide Traditional Name: N-(3-bromophenyl)-6,7-dimethoxy-3,4-dihydroimidaz[1,2-a]indol-9-ium-1-sulfonamide Formula: C18H17BrN3O4S+ MolecularWeight: 451.31428

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CC3=[N+]2C(=CN3)S(=O)(=O)NC4=CC(=CC=C4)Br)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)CC3=[N+]2C(=CN3)S(=O)(=O)NC4=CC(=CC=C4)Br)OC

InChI

InChI=1S/C18H16BrN3O4S/c1-25-15-6-11-7-17-20-10-18(22(17)14(11)9-16(15)26-2)27(23,24)21-13-5-3-4-12(19)8-13/h3-6,8-10,21H,7H2,1-2H3/p+1