1-[7,7-bis(diethoxyphosphoryl)-7-(4-phenylmethoxyphenoxy)hept-1-ynyl]-2-phenylmethoxy-benzene

Systemtic Name: 1-[7,7-bis(diethoxyphosphoryl)-7-(4-phenylmethoxyphenoxy)hept-1-ynyl]-2-phenylmethoxy-benzene Openeye Name: 1-benzyloxy-2-[7-(4-benzyloxyphenoxy)-7,7-bis(diethoxyphosphoryl)hept-1-ynyl]benzene CAS Name: 1-[7,7-bis(diethoxyphosphoryl)-7-(4-phenylmethoxyphenoxy)hept-1-ynyl]-2-phenylmethoxybenzene IUPAC Name: 1-[7,7-bis(diethoxyphosphoryl)-7-(4-phenylmethoxyphenoxy)hept-1-ynyl]-2-phenylmethoxybenzene Traditional Name: 1-benzoxy-2-[7-(4-benzoxyphenoxy)-7,7-bis(diethoxyphosphoryl)hept-1-ynyl]benzene Formula: C41H50O9P2 MolecularWeight: 748.777822

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(CCCCC#CC1=CC=CC=C1OCC2=CC=CC=C2)(OC3=CC=C(C=C3)OCC4=CC=CC=C4)P(=O)(OCC)OCC)OCC

Isomeric SMILES

CCOP(=O)(C(CCCCC#CC1=CC=CC=C1OCC2=CC=CC=C2)(OC3=CC=C(C=C3)OCC4=CC=CC=C4)P(=O)(OCC)OCC)OCC

InChI

InChI=1S/C41H50O9P2/c1-5-46-51(42,47-6-2)41(52(43,48-7-3)49-8-4,50-39-30-28-38(29-31-39)44-33-35-21-13-11-14-22-35)32-20-10-9-17-25-37-26-18-19-27-40(37)45-34-36-23-15-12-16-24-36/h11-16,18-19,21-24,26-31H,5-10,20,32-34H2,1-4H3