10-(4-bromophenyl)-9-(2,6-dimethoxyphenyl)-1,8-dimethoxy-acridin-10-ium tetrafluoroborate

Systemtic Name: 10-(4-bromophenyl)-9-(2,6-dimethoxyphenyl)-1,8-dimethoxy-acridin-10-ium tetrafluoroborate Openeye Name: 10-(4-bromophenyl)-9-(2,6-dimethoxyphenyl)-1,8-dimethoxy-acridin-10-ium tetrafluoroborate CAS Name: 10-(4-bromophenyl)-9-(2,6-dimethoxyphenyl)-1,8-dimethoxyacridin-10-ium tetrafluoroborate IUPAC Name: 10-(4-bromophenyl)-9-(2,6-dimethoxyphenyl)-1,8-dimethoxyacridin-10-ium tetrafluoroborate Traditional Name: 10-(4-bromophenyl)-9-(2,6-dimethoxyphenyl)-1,8-dimethoxy-acridin-10-ium tetrafluoroborate Formula: C29H25BBrF4NO4 MolecularWeight: 618.221713

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.COC1=C(C(=CC=C1)OC)C2=C3C(=[N+](C4=C2C(=CC=C4)OC)C5=CC=C(C=C5)Br)C=CC=C3OC

Isomeric SMILES

[B-](F)(F)(F)F.COC1=C(C(=CC=C1)OC)C2=C3C(=[N+](C4=C2C(=CC=C4)OC)C5=CC=C(C=C5)Br)C=CC=C3OC

InChI

InChI=1S/C29H25BrNO4.BF4/c1-32-22-10-5-8-20-26(22)29(28-24(34-3)12-7-13-25(28)35-4)27-21(9-6-11-23(27)33-2)31(20)19-16-14-18(30)15-17-19;2-1(3,4)5/h5-17H,1-4H3;/q+1;-1