methyl 4-[3-(diphenylphosphorylamino)-3-phenyl-prop-1-ynyl]benzoate

Systemtic Name: methyl 4-[3-(diphenylphosphorylamino)-3-phenyl-prop-1-ynyl]benzoate Openeye Name: methyl 4-[3-(diphenylphosphorylamino)-3-phenyl-prop-1-ynyl]benzoate CAS Name: 4-[3-(diphenylphosphorylamino)-3-phenylprop-1-ynyl]benzoic acid methyl ester IUPAC Name: methyl 4-[3-(diphenylphosphorylamino)-3-phenylprop-1-ynyl]benzoate Traditional Name: 4-[3-(diphenylphosphorylamino)-3-phenyl-prop-1-ynyl]benzoic acid methyl ester Formula: C29H24NO3P MolecularWeight: 465.479521

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H24NO3P/c1-33-29(31)25-20-17-23(18-21-25)19-22-28(24-11-5-2-6-12-24)30-34(32,26-13-7-3-8-14-26)27-15-9-4-10-16-27/h2-18,20-21,28H,1H3,(H,30,32)