triphenyl-[3-(1,2,3,4-tetrazol-2-yl)propyl]phosphanium bromide

Systemtic Name: triphenyl-[3-(1,2,3,4-tetrazol-2-yl)propyl]phosphanium bromide Openeye Name: triphenyl-[3-(tetrazol-2-yl)propyl]phosphonium bromide CAS Name: triphenyl-[3-(2-tetrazolyl)propyl]phosphonium bromide IUPAC Name: triphenyl-[3-(tetrazol-2-yl)propyl]phosphanium bromide Traditional Name: triphenyl-[3-(tetrazol-2-yl)propyl]phosphonium bromide Formula: C22H22BrN4P MolecularWeight: 453.314641

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[P+](CCCN2N=CN=N2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)[P+](CCCN2N=CN=N2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

InChI

InChI=1S/C22H22N4P.BrH/c1-4-11-20(12-5-1)27(21-13-6-2-7-14-21,22-15-8-3-9-16-22)18-10-17-26-24-19-23-25-26;/h1-9,11-16,19H,10,17-18H2;1H/q+1;/p-1