1-[3-(diphenylphosphorylmethyl)but-3-en-1-ynyl]-4-nitro-benzene

Systemtic Name: 1-[3-(diphenylphosphorylmethyl)but-3-en-1-ynyl]-4-nitro-benzene Openeye Name: 1-[3-(diphenylphosphorylmethyl)but-3-en-1-ynyl]-4-nitro-benzene CAS Name: 1-[3-(diphenylphosphorylmethyl)but-3-en-1-ynyl]-4-nitrobenzene IUPAC Name: 1-[3-(diphenylphosphorylmethyl)but-3-en-1-ynyl]-4-nitrobenzene Traditional Name: 1-[3-(diphenylphosphorylmethyl)but-3-en-1-ynyl]-4-nitro-benzene Formula: C23H18NO3P MolecularWeight: 387.367681

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=C(CP(=O)(C1=CC=CC=C1)C2=CC=CC=C2)C#CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C=C(CP(=O)(C1=CC=CC=C1)C2=CC=CC=C2)C#CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H18NO3P/c1-19(12-13-20-14-16-21(17-15-20)24(25)26)18-28(27,22-8-4-2-5-9-22)23-10-6-3-7-11-23/h2-11,14-17H,1,18H2