3-methyl-4,8-diphenyl-1,2-dihydropyrido[2,1-b][1,3]benzoxazol-10-ium bromide

Systemtic Name: 3-methyl-4,8-diphenyl-1,2-dihydropyrido[2,1-b][1,3]benzoxazol-10-ium bromide Openeye Name: 3-methyl-4,8-diphenyl-1,2-dihydropyrido[2,1-b][1,3]benzoxazol-10-ium bromide CAS Name: 3-methyl-4,8-diphenyl-1,2-dihydropyrido[2,1-b][1,3]benzoxazol-10-ium bromide IUPAC Name: 3-methyl-4,8-diphenyl-1,2-dihydropyrido[2,1-b][1,3]benzoxazol-10-ium bromide Traditional Name: 3-methyl-4,8-diphenyl-1,2-dihydropyrido[2,1-b][1,3]benzoxazol-10-ium bromide Formula: C24H20BrNO MolecularWeight: 418.3257

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=[N+](CC1)C3=C(O2)C=CC(=C3)C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

Isomeric SMILES

CC1=C(C2=[N+](CC1)C3=C(O2)C=CC(=C3)C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

InChI

InChI=1S/C24H20NO.BrH/c1-17-14-15-25-21-16-20(18-8-4-2-5-9-18)12-13-22(21)26-24(25)23(17)19-10-6-3-7-11-19;/h2-13,16H,14-15H2,1H3;1H/q+1;/p-1