3-[2-(dioxidanylmethyl)-6-oxidanylidene-benzo[c][2,1]benzoxaphosphinin-6-yl]propanoic acid

Systemtic Name: 3-[2-(dioxidanylmethyl)-6-oxidanylidene-benzo[c][2,1]benzoxaphosphinin-6-yl]propanoic acid Openeye Name: 3-[2-(hydroperoxymethyl)-6-oxo-benzo[c][2,1]benzoxaphosphinin-6-yl]propanoic acid CAS Name: 3-[2-(hydroperoxymethyl)-6-oxo-6-benzo[c][2,1]benzoxaphosphorinyl]propanoic acid IUPAC Name: 3-[2-(hydroperoxymethyl)-6-oxobenzo[c][2,1]benzoxaphosphinin-6-yl]propanoic acid Traditional Name: 3-[2-(hydroperoxymethyl)-6-keto-benzo[c][2,1]benzoxaphosphorin-6-yl]propionic acid Formula: C16H15O6P MolecularWeight: 334.260461

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(C=CC(=C3)COO)OP2(=O)CCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(C=CC(=C3)COO)OP2(=O)CCC(=O)O

InChI

InChI=1S/C16H15O6P/c17-16(18)7-8-23(20)15-4-2-1-3-12(15)13-9-11(10-21-19)5-6-14(13)22-23/h1-6,9,19H,7-8,10H2,(H,17,18)