4-(1-diethoxyphosphoryl-3,3-dimethoxy-propyl)benzoic acid

Systemtic Name: 4-(1-diethoxyphosphoryl-3,3-dimethoxy-propyl)benzoic acid Openeye Name: 4-(1-diethoxyphosphoryl-3,3-dimethoxy-propyl)benzoic acid CAS Name: 4-(1-diethoxyphosphoryl-3,3-dimethoxypropyl)benzoic acid IUPAC Name: 4-(1-diethoxyphosphoryl-3,3-dimethoxypropyl)benzoic acid Traditional Name: 4-(1-diethoxyphosphoryl-3,3-dimethoxy-propyl)benzoic acid Formula: C16H25O7P MolecularWeight: 360.339261

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(CC(OC)OC)C1=CC=C(C=C1)C(=O)O)OCC

Isomeric SMILES

CCOP(=O)(C(CC(OC)OC)C1=CC=C(C=C1)C(=O)O)OCC

InChI

InChI=1S/C16H25O7P/c1-5-22-24(19,23-6-2)14(11-15(20-3)21-4)12-7-9-13(10-8-12)16(17)18/h7-10,14-15H,5-6,11H2,1-4H3,(H,17,18)