4,4-bis(diethoxyphosphoryl)but-1-ynylbenzene

Systemtic Name: 4,4-bis(diethoxyphosphoryl)but-1-ynylbenzene Openeye Name: 4,4-bis(diethoxyphosphoryl)but-1-ynylbenzene CAS Name: 4,4-bis(diethoxyphosphoryl)but-1-ynylbenzene IUPAC Name: 4,4-bis(diethoxyphosphoryl)but-1-ynylbenzene Traditional Name: 4,4-bis(diethoxyphosphoryl)but-1-ynylbenzene Formula: C18H28O6P2 MolecularWeight: 402.358842

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(CC#CC1=CC=CC=C1)P(=O)(OCC)OCC)OCC

Isomeric SMILES

CCOP(=O)(C(CC#CC1=CC=CC=C1)P(=O)(OCC)OCC)OCC

InChI

InChI=1S/C18H28O6P2/c1-5-21-25(19,22-6-2)18(26(20,23-7-3)24-8-4)16-12-15-17-13-10-9-11-14-17/h9-11,13-14,18H,5-8,16H2,1-4H3