cyanomethyl(triphenyl)phosphanium; triphenylphosphane

Systemtic Name: cyanomethyl(triphenyl)phosphanium; triphenylphosphane Openeye Name: cyanomethyl(triphenyl)phosphonium; triphenylphosphane CAS Name: cyanomethyl(triphenyl)phosphonium; triphenylphosphine IUPAC Name: cyanomethyl(triphenyl)phosphanium; triphenylphosphane Traditional Name: cyanomethyl(triphenyl)phosphonium; triphenylphosphine Formula: C56H47NP3+ MolecularWeight: 826.900363

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)[P+](CC#N)(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)[P+](CC#N)(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C20H17NP.2C18H15P/c21-16-17-22(18-10-4-1-5-11-18,19-12-6-2-7-13-19)20-14-8-3-9-15-20;2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-15H,17H2;2*1-15H/q+1;;