4-(2,3-dihydro-1,4-benzodioxin-6-yl)-N,3-diphenyl-1,3-thiazol-3-ium-2-amine bromide

Systemtic Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-N,3-diphenyl-1,3-thiazol-3-ium-2-amine bromide Openeye Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-N,3-diphenyl-thiazol-3-ium-2-amine bromide CAS Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-N,3-diphenyl-2-thiazol-3-iumamine bromide IUPAC Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-N,3-diphenyl-1,3-thiazol-3-ium-2-amine bromide Traditional Name: [4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-phenyl-thiazol-3-ium-2-yl]-phenyl-amine bromide Formula: C23H19BrN2O2S MolecularWeight: 467.37816

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C3=CSC(=[N+]3C4=CC=CC=C4)NC5=CC=CC=C5.[Br-]

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C3=CSC(=[N+]3C4=CC=CC=C4)NC5=CC=CC=C5.[Br-]

InChI

InChI=1S/C23H18N2O2S.BrH/c1-3-7-18(8-4-1)24-23-25(19-9-5-2-6-10-19)20(16-28-23)17-11-12-21-22(15-17)27-14-13-26-21;/h1-12,15-16H,13-14H2;1H