5-chloranyl-2,4,6-tris[(triphenyl-$l^{5}-phosphanylidene)amino]pyridine-3-carbonitrile

Systemtic Name: 5-chloranyl-2,4,6-tris[(triphenyl-$l^{5}-phosphanylidene)amino]pyridine-3-carbonitrile Openeye Name: 5-chloro-2,4,6-tris[(triphenyl-$l^{5}-phosphanylidene)amino]pyridine-3-carbonitrile CAS Name: 5-chloro-2,4,6-tris(triphenylphosphoranylideneamino)-3-pyridinecarbonitrile IUPAC Name: 5-chloro-2,4,6-tris[(triphenyl-$l^{5}-phosphanylidene)amino]pyridine-3-carbonitrile Traditional Name: 5-chloro-2,4,6-tris(triphenylphosphoranylideneamino)nicotinonitrile Formula: C60H45ClN5P3 MolecularWeight: 964.407083

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)P(=NC2=C(C(=NC(=C2Cl)N=P(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)N=P(C6=CC=CC=C6)(C7=CC=CC=C7)C8=CC=CC=C8)C#N)(C9=CC=CC=C9)C1=CC=CC=C1

Isomeric SMILES

C1=CC=C(C=C1)P(=NC2=C(C(=NC(=C2Cl)N=P(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)N=P(C6=CC=CC=C6)(C7=CC=CC=C7)C8=CC=CC=C8)C#N)(C9=CC=CC=C9)C1=CC=CC=C1

InChI

InChI=1S/C60H45ClN5P3/c61-57-58(64-67(47-28-10-1-11-29-47,48-30-12-2-13-31-48)49-32-14-3-15-33-49)56(46-62)59(65-68(50-34-16-4-17-35-50,51-36-18-5-19-37-51)52-38-20-6-21-39-52)63-60(57)66-69(53-40-22-7-23-41-53,54-42-24-8-25-43-54)55-44-26-9-27-45-55/h1-45H