butanedioate; tris(4-methylphenyl)-[(4-methylphenyl)methyl]phosphanium

Systemtic Name: butanedioate; tris(4-methylphenyl)-[(4-methylphenyl)methyl]phosphanium Openeye Name: butanedioate; tris-p-tolyl(p-tolylmethyl)phosphonium CAS Name: butanedioate; tris(4-methylphenyl)-[(4-methylphenyl)methyl]phosphonium IUPAC Name: butanedioate; tris(4-methylphenyl)-[(4-methylphenyl)methyl]phosphanium Traditional Name: (4-methylbenzyl)-tris(p-tolyl)phosphonium; succinate Formula: C62H64O4P2 MolecularWeight: 935.116682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[P+](C2=CC=C(C=C2)C)(C3=CC=C(C=C3)C)C4=CC=C(C=C4)C.CC1=CC=C(C=C1)C[P+](C2=CC=C(C=C2)C)(C3=CC=C(C=C3)C)C4=CC=C(C=C4)C.C(CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C[P+](C2=CC=C(C=C2)C)(C3=CC=C(C=C3)C)C4=CC=C(C=C4)C.CC1=CC=C(C=C1)C[P+](C2=CC=C(C=C2)C)(C3=CC=C(C=C3)C)C4=CC=C(C=C4)C.C(CC(=O)[O-])C(=O)[O-]

InChI

InChI=1S/2C29H30P.C4H6O4/c2*1-22-5-13-26(14-6-22)21-30(27-15-7-23(2)8-16-27,28-17-9-24(3)10-18-28)29-19-11-25(4)12-20-29;5-3(6)1-2-4(7)8/h2*5-20H,21H2,1-4H3;1-2H2,(H,5,6)(H,7,8)/q2*+1;/p-2