2-sulfooxyethyl benzoate

Systemtic Name: 2-sulfooxyethyl benzoate Openeye Name: 2-sulfooxyethyl benzoate CAS Name: benzoic acid 2-sulfooxyethyl ester IUPAC Name: 2-sulfooxyethyl benzoate Traditional Name: benzoic acid 2-sulfoxyethyl ester Formula: C9H10O6S MolecularWeight: 246.2371

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OCCOS(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OCCOS(=O)(=O)O

InChI

InChI=1S/C9H10O6S/c10-9(8-4-2-1-3-5-8)14-6-7-15-16(11,12)13/h1-5H,6-7H2,(H,11,12,13)