(E)-N-diphenylphosphoryl-1,5-diphenyl-pent-1-en-4-yn-3-amine

Systemtic Name: (E)-N-diphenylphosphoryl-1,5-diphenyl-pent-1-en-4-yn-3-amine Openeye Name: (E)-N-diphenylphosphoryl-1,5-diphenyl-pent-1-en-4-yn-3-amine CAS Name: (E)-N-diphenylphosphoryl-1,5-diphenyl-3-pent-1-en-4-ynamine IUPAC Name: (E)-N-diphenylphosphoryl-1,5-diphenylpent-1-en-4-yn-3-amine Traditional Name: diphenylphosphoryl-[(E)-3-phenyl-1-(2-phenylethynyl)allyl]amine Formula: C29H24NOP MolecularWeight: 433.480721

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC(C#CC2=CC=CC=C2)NP(=O)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)/C=C/C(C#CC2=CC=CC=C2)NP(=O)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C29H24NOP/c31-32(28-17-9-3-10-18-28,29-19-11-4-12-20-29)30-27(23-21-25-13-5-1-6-14-25)24-22-26-15-7-2-8-16-26/h1-21,23,27H,(H,30,31)/b23-21+