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

Systemtic Name: 2-bromanyl-N-[4-(2-butyl-6-phenyl-phenyl)-4-methyl-5-phenyl-2H-1,2,3,4-tetrazol-4-ium-3-yl]-2-methyl-propanamide Openeye Name: 2-bromo-N-[4-(2-butyl-6-phenyl-phenyl)-4-methyl-5-phenyl-2H-tetrazol-4-ium-3-yl]-2-methyl-propanamide CAS Name: 2-bromo-N-[4-(2-butyl-6-phenylphenyl)-4-methyl-5-phenyl-2H-tetrazol-4-ium-3-yl]-2-methylpropanamide IUPAC Name: 2-bromo-N-[4-(2-butyl-6-phenylphenyl)-4-methyl-5-phenyl-2H-tetrazol-4-ium-3-yl]-2-methylpropanamide Traditional Name: 2-bromo-N-[4-(2-butyl-6-phenyl-phenyl)-4-methyl-5-phenyl-2H-tetrazol-4-ium-3-yl]-2-methyl-propionamide Formula: C28H33BrN5O+ MolecularWeight: 535.49852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H32BrN5O/c1-5-6-14-22-19-13-20-24(21-15-9-7-10-16-21)25(22)34(4)26(23-17-11-8-12-18-23)30-32-33(34)31-27(35)28(2,3)29/h7-13,15-20,32H,5-6,14H2,1-4H3/p+1