5-[1,3-bis(phenylmethoxy)propyl]-2-(2-methoxy-2-oxidanylidene-ethyl)benzenesulfinic acid

Systemtic Name: 5-[1,3-bis(phenylmethoxy)propyl]-2-(2-methoxy-2-oxidanylidene-ethyl)benzenesulfinic acid Openeye Name: 5-(1,3-dibenzyloxypropyl)-2-(2-methoxy-2-oxo-ethyl)benzenesulfinic acid CAS Name: 5-[1,3-bis(phenylmethoxy)propyl]-2-(2-methoxy-2-oxoethyl)benzenesulfinic acid IUPAC Name: 5-[1,3-bis(phenylmethoxy)propyl]-2-(2-methoxy-2-oxoethyl)benzenesulfinic acid Traditional Name: 5-(1,3-dibenzoxypropyl)-2-(2-keto-2-methoxy-ethyl)benzenesulfinic acid Formula: C26H28O6S MolecularWeight: 468.56192

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=C(C=C(C=C1)C(CCOCC2=CC=CC=C2)OCC3=CC=CC=C3)S(=O)O

Isomeric SMILES

COC(=O)CC1=C(C=C(C=C1)C(CCOCC2=CC=CC=C2)OCC3=CC=CC=C3)S(=O)O

InChI

InChI=1S/C26H28O6S/c1-30-26(27)17-23-13-12-22(16-25(23)33(28)29)24(32-19-21-10-6-3-7-11-21)14-15-31-18-20-8-4-2-5-9-20/h2-13,16,24H,14-15,17-19H2,1H3,(H,28,29)