(4-cyanophenyl)methyl-dimethyl-[(3-tetracen-5-ylphenyl)methyl]azanium bromide

Systemtic Name: (4-cyanophenyl)methyl-dimethyl-[(3-tetracen-5-ylphenyl)methyl]azanium bromide Openeye Name: (4-cyanophenyl)methyl-dimethyl-[(3-tetracen-5-ylphenyl)methyl]ammonium bromide CAS Name: (4-cyanophenyl)methyl-dimethyl-[[3-(5-tetracenyl)phenyl]methyl]ammonium bromide IUPAC Name: (4-cyanophenyl)methyl-dimethyl-[(3-tetracen-5-ylphenyl)methyl]azanium bromide Traditional Name: (4-cyanobenzyl)-dimethyl-(3-tetracen-5-ylbenzyl)ammonium bromide Formula: C35H29BrN2 MolecularWeight: 557.52216

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CC1=CC=C(C=C1)C#N)CC2=CC=CC(=C2)C3=C4C=CC=CC4=CC5=CC6=CC=CC=C6C=C53.[Br-]

Isomeric SMILES

C[N+](C)(CC1=CC=C(C=C1)C#N)CC2=CC=CC(=C2)C3=C4C=CC=CC4=CC5=CC6=CC=CC=C6C=C53.[Br-]

InChI

InChI=1S/C35H29N2.BrH/c1-37(2,23-26-16-14-25(22-36)15-17-26)24-27-8-7-12-31(18-27)35-33-13-6-5-11-30(33)20-32-19-28-9-3-4-10-29(28)21-34(32)35;/h3-21H,23-24H2,1-2H3;1H/q+1;/p-1