2-sulfooxyethyl 4-azanylbenzenesulfinate

Systemtic Name: 2-sulfooxyethyl 4-azanylbenzenesulfinate Openeye Name: 2-sulfooxyethyl 4-aminobenzenesulfinate CAS Name: 4-aminobenzenesulfinic acid 2-sulfooxyethyl ester IUPAC Name: 2-sulfooxyethyl 4-aminobenzenesulfinate Traditional Name: 4-aminobenzenesulfinic acid 2-sulfoxyethyl ester Formula: C8H11NO6S2 MolecularWeight: 281.30604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N)S(=O)OCCOS(=O)(=O)O

Isomeric SMILES

C1=CC(=CC=C1N)S(=O)OCCOS(=O)(=O)O

InChI

InChI=1S/C8H11NO6S2/c9-7-1-3-8(4-2-7)16(10)14-5-6-15-17(11,12)13/h1-4H,5-6,9H2,(H,11,12,13)