2-[bis(prop-2-enoxy)phosphoryloxymethyl]-5-cyano-benzoic acid

Systemtic Name: 2-[bis(prop-2-enoxy)phosphoryloxymethyl]-5-cyano-benzoic acid Openeye Name: 5-cyano-2-(diallyloxyphosphoryloxymethyl)benzoic acid CAS Name: 2-[bis(prop-2-enoxy)phosphoryloxymethyl]-5-cyanobenzoic acid IUPAC Name: 2-[bis(prop-2-enoxy)phosphoryloxymethyl]-5-cyanobenzoic acid Traditional Name: 5-cyano-2-(diallyloxyphosphoryloxymethyl)benzoic acid Formula: C15H16NO6P MolecularWeight: 337.264401

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOP(=O)(OCC=C)OCC1=C(C=C(C=C1)C#N)C(=O)O

Isomeric SMILES

C=CCOP(=O)(OCC=C)OCC1=C(C=C(C=C1)C#N)C(=O)O

InChI

InChI=1S/C15H16NO6P/c1-3-7-20-23(19,21-8-4-2)22-11-13-6-5-12(10-16)9-14(13)15(17)18/h3-6,9H,1-2,7-8,11H2,(H,17,18)