1-methyl-2,9-bis(phenylmethyl)pyrido[3,4-b]indol-2-ium bromide

Systemtic Name: 1-methyl-2,9-bis(phenylmethyl)pyrido[3,4-b]indol-2-ium bromide Openeye Name: 2,9-dibenzyl-1-methyl-pyrido[3,4-b]indol-2-ium bromide CAS Name: 1-methyl-2,9-bis(phenylmethyl)pyrido[3,4-b]indol-2-ium bromide IUPAC Name: 2,9-dibenzyl-1-methylpyrido[3,4-b]indol-2-ium bromide Traditional Name: 2,9-dibenzyl-1-methyl-$b-carbolin-2-ium bromide Formula: C26H23BrN2 MolecularWeight: 443.37822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C=CC2=C1N(C3=CC=CC=C23)CC4=CC=CC=C4)CC5=CC=CC=C5.[Br-]

Isomeric SMILES

CC1=[N+](C=CC2=C1N(C3=CC=CC=C23)CC4=CC=CC=C4)CC5=CC=CC=C5.[Br-]

InChI

InChI=1S/C26H23N2.BrH/c1-20-26-24(16-17-27(20)18-21-10-4-2-5-11-21)23-14-8-9-15-25(23)28(26)19-22-12-6-3-7-13-22;/h2-17H,18-19H2,1H3;1H/q+1;/p-1