3-bromanyl-N-[4-(2-butyl-6-phenyl-phenyl)-4-methyl-5-phenyl-2H-1,2,3,4-tetrazol-4-ium-3-yl]-2,2-dimethyl-propanamide

Systemtic Name: 3-bromanyl-N-[4-(2-butyl-6-phenyl-phenyl)-4-methyl-5-phenyl-2H-1,2,3,4-tetrazol-4-ium-3-yl]-2,2-dimethyl-propanamide Openeye Name: 3-bromo-N-[4-(2-butyl-6-phenyl-phenyl)-4-methyl-5-phenyl-2H-tetrazol-4-ium-3-yl]-2,2-dimethyl-propanamide CAS Name: 3-bromo-N-[4-(2-butyl-6-phenylphenyl)-4-methyl-5-phenyl-2H-tetrazol-4-ium-3-yl]-2,2-dimethylpropanamide IUPAC Name: 3-bromo-N-[4-(2-butyl-6-phenylphenyl)-4-methyl-5-phenyl-2H-tetrazol-4-ium-3-yl]-2,2-dimethylpropanamide Traditional Name: 3-bromo-N-[4-(2-butyl-6-phenyl-phenyl)-4-methyl-5-phenyl-2H-tetrazol-4-ium-3-yl]-2,2-dimethyl-propionamide Formula: C29H35BrN5O+ MolecularWeight: 549.5251

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=CC(=C1[N+]2(C(=NNN2NC(=O)C(C)(C)CBr)C3=CC=CC=C3)C)C4=CC=CC=C4

Isomeric SMILES

CCCCC1=CC=CC(=C1[N+]2(C(=NNN2NC(=O)C(C)(C)CBr)C3=CC=CC=C3)C)C4=CC=CC=C4

InChI

InChI=1S/C29H34BrN5O/c1-5-6-14-23-19-13-20-25(22-15-9-7-10-16-22)26(23)35(4)27(24-17-11-8-12-18-24)31-33-34(35)32-28(36)29(2,3)21-30/h7-13,15-20,33H,5-6,14,21H2,1-4H3/p+1