1-(2,2-dimethylpropyl)-2,4-diphenyl-5,6-dihydrobenzo[h]quinolin-1-ium bromide

Systemtic Name: 1-(2,2-dimethylpropyl)-2,4-diphenyl-5,6-dihydrobenzo[h]quinolin-1-ium bromide Openeye Name: 1-(2,2-dimethylpropyl)-2,4-diphenyl-5,6-dihydrobenzo[h]quinolin-1-ium bromide CAS Name: 1-(2,2-dimethylpropyl)-2,4-diphenyl-5,6-dihydrobenzo[h]quinolin-1-ium bromide IUPAC Name: 1-(2,2-dimethylpropyl)-2,4-diphenyl-5,6-dihydrobenzo[h]quinolin-1-ium bromide Traditional Name: 1-neopentyl-2,4-diphenyl-5,6-dihydrobenzo[h]quinolin-1-ium bromide Formula: C30H30BrN MolecularWeight: 484.4699

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C[N+]1=C(C=C(C2=C1C3=CC=CC=C3CC2)C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

Isomeric SMILES

CC(C)(C)C[N+]1=C(C=C(C2=C1C3=CC=CC=C3CC2)C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

InChI

InChI=1S/C30H30N.BrH/c1-30(2,3)21-31-28(24-15-8-5-9-16-24)20-27(22-12-6-4-7-13-22)26-19-18-23-14-10-11-17-25(23)29(26)31;/h4-17,20H,18-19,21H2,1-3H3;1H/q+1;/p-1