4-[4-[4-[2-(dioxidanylmethyl)prop-2-enyl]phenyl]iodanuidylphenyl]butanoic acid

Systemtic Name: 4-[4-[4-[2-(dioxidanylmethyl)prop-2-enyl]phenyl]iodanuidylphenyl]butanoic acid Openeye Name: 4-[4-[4-[2-(hydroperoxymethyl)allyl]phenyl]iodanuidylphenyl]butanoic acid CAS Name: 4-[4-[4-[2-(hydroperoxymethyl)prop-2-enyl]phenyl]iodanuidylphenyl]butanoic acid IUPAC Name: 4-[4-[4-[2-(hydroperoxymethyl)prop-2-enyl]phenyl]iodanuidylphenyl]butanoic acid Traditional Name: 4-[4-[4-[2-(hydroperoxymethyl)allyl]phenyl]iodanuidylphenyl]butyric acid Formula: C20H22IO4- MolecularWeight: 453.29075

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Descriptors Computed from Structure

Canonical SMILES:

C=C(CC1=CC=C(C=C1)[I-]C2=CC=C(C=C2)CCCC(=O)O)COO

Isomeric SMILES

C=C(CC1=CC=C(C=C1)[I-]C2=CC=C(C=C2)CCCC(=O)O)COO

InChI

InChI=1S/C20H22IO4/c1-15(14-25-24)13-17-7-11-19(12-8-17)21-18-9-5-16(6-10-18)3-2-4-20(22)23/h5-12,24H,1-4,13-14H2,(H,22,23)/q-1