(4-tert-butylphenyl)methyl-[[4-(triphenylphosphaniumylmethyl)phenyl]methyl]azanium

Systemtic Name: (4-tert-butylphenyl)methyl-[[4-(triphenylphosphaniumylmethyl)phenyl]methyl]azanium Openeye Name: (4-tert-butylphenyl)methyl-[[4-(triphenylphosphaniumylmethyl)phenyl]methyl]ammonium CAS Name: (4-tert-butylphenyl)methyl-[[4-(triphenylphosphiniumylmethyl)phenyl]methyl]ammonium IUPAC Name: (4-tert-butylphenyl)methyl-[[4-(triphenylphosphaniumylmethyl)phenyl]methyl]azanium Traditional Name: (4-tert-butylbenzyl)-[4-(triphenylphosphiniumylmethyl)benzyl]ammonium Formula: C37H40NP+2 MolecularWeight: 529.693961

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C[NH2+]CC2=CC=C(C=C2)C[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C[NH2+]CC2=CC=C(C=C2)C[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C37H39NP/c1-37(2,3)33-25-23-31(24-26-33)28-38-27-30-19-21-32(22-20-30)29-39(34-13-7-4-8-14-34,35-15-9-5-10-16-35)36-17-11-6-12-18-36/h4-26,38H,27-29H2,1-3H3/q+1/p+1