2-sulfooxyethyl 4-methoxy-3-methyl-benzenesulfinate

Systemtic Name: 2-sulfooxyethyl 4-methoxy-3-methyl-benzenesulfinate Openeye Name: 2-sulfooxyethyl 4-methoxy-3-methyl-benzenesulfinate CAS Name: 4-methoxy-3-methylbenzenesulfinic acid 2-sulfooxyethyl ester IUPAC Name: 2-sulfooxyethyl 4-methoxy-3-methylbenzenesulfinate Traditional Name: 4-methoxy-3-methyl-benzenesulfinic acid 2-sulfoxyethyl ester Formula: C10H14O7S2 MolecularWeight: 310.34396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)OCCOS(=O)(=O)O)OC

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)OCCOS(=O)(=O)O)OC

InChI

InChI=1S/C10H14O7S2/c1-8-7-9(3-4-10(8)15-2)18(11)16-5-6-17-19(12,13)14/h3-4,7H,5-6H2,1-2H3,(H,12,13,14)