2-sulfooxyethyl (3-aminophenyl)methanesulfonate

Systemtic Name: 2-sulfooxyethyl (3-aminophenyl)methanesulfonate Openeye Name: 2-sulfooxyethyl (3-aminophenyl)methanesulfonate CAS Name: (3-aminophenyl)methanesulfonic acid 2-sulfooxyethyl ester IUPAC Name: 2-sulfooxyethyl (3-aminophenyl)methanesulfonate Traditional Name: (3-aminophenyl)methanesulfonic acid 2-sulfoxyethyl ester Formula: C9H13NO7S2 MolecularWeight: 311.33202

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N)CS(=O)(=O)OCCOS(=O)(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)N)CS(=O)(=O)OCCOS(=O)(=O)O

InChI

InChI=1S/C9H13NO7S2/c10-9-3-1-2-8(6-9)7-18(11,12)16-4-5-17-19(13,14)15/h1-3,6H,4-5,7,10H2,(H,13,14,15)