bis[2-bis(4-methylphenyl)phosphanylethyl]-tert-butyl-azanium

Systemtic Name: bis[2-bis(4-methylphenyl)phosphanylethyl]-tert-butyl-azanium Openeye Name: bis[2-(bis-p-tolylphosphanyl)ethyl]-tert-butyl-ammonium CAS Name: bis[2-bis(4-methylphenyl)phosphinoethyl]-tert-butylammonium IUPAC Name: bis[2-bis(4-methylphenyl)phosphanylethyl]-tert-butylazanium Traditional Name: bis[2-(bis-p-tolylphosphino)ethyl]-tert-butyl-ammonium Formula: C36H46NP2+ MolecularWeight: 554.704662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)P(CC[NH+](CCP(C2=CC=C(C=C2)C)C3=CC=C(C=C3)C)C(C)(C)C)C4=CC=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)P(CC[NH+](CCP(C2=CC=C(C=C2)C)C3=CC=C(C=C3)C)C(C)(C)C)C4=CC=C(C=C4)C

InChI

InChI=1S/C36H45NP2/c1-28-8-16-32(17-9-28)38(33-18-10-29(2)11-19-33)26-24-37(36(5,6)7)25-27-39(34-20-12-30(3)13-21-34)35-22-14-31(4)15-23-35/h8-23H,24-27H2,1-7H3/p+1