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

Systemtic Name: 2-bromanyl-N-[4-methyl-5-phenyl-4-(2-phenyl-6-propyl-phenyl)-2H-1,2,3,4-tetrazol-4-ium-3-yl]propanamide Openeye Name: 2-bromo-N-[4-methyl-5-phenyl-4-(2-phenyl-6-propyl-phenyl)-2H-tetrazol-4-ium-3-yl]propanamide CAS Name: 2-bromo-N-[4-methyl-5-phenyl-4-(2-phenyl-6-propylphenyl)-2H-tetrazol-4-ium-3-yl]propanamide IUPAC Name: 2-bromo-N-[4-methyl-5-phenyl-4-(2-phenyl-6-propylphenyl)-2H-tetrazol-4-ium-3-yl]propanamide Traditional Name: 2-bromo-N-[4-methyl-5-phenyl-4-(2-phenyl-6-propyl-phenyl)-2H-tetrazol-4-ium-3-yl]propionamide Formula: C26H29BrN5O+ MolecularWeight: 507.44536

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=CC(=C1[N+]2(C(=NNN2NC(=O)C(C)Br)C3=CC=CC=C3)C)C4=CC=CC=C4

Isomeric SMILES

CCCC1=CC=CC(=C1[N+]2(C(=NNN2NC(=O)C(C)Br)C3=CC=CC=C3)C)C4=CC=CC=C4

InChI

InChI=1S/C26H28BrN5O/c1-4-12-21-17-11-18-23(20-13-7-5-8-14-20)24(21)32(3)25(22-15-9-6-10-16-22)28-30-31(32)29-26(33)19(2)27/h5-11,13-19,30H,4,12H2,1-3H3/p+1