[2-(2-azanyl-1-oxidanyl-2-oxidanylidene-ethyl)phenyl] benzenesulfonate

Systemtic Name: [2-(2-azanyl-1-oxidanyl-2-oxidanylidene-ethyl)phenyl] benzenesulfonate Openeye Name: [2-(2-amino-1-hydroxy-2-oxo-ethyl)phenyl] benzenesulfonate CAS Name: benzenesulfonic acid [2-(2-amino-1-hydroxy-2-oxoethyl)phenyl] ester IUPAC Name: [2-(2-amino-1-hydroxy-2-oxoethyl)phenyl] benzenesulfonate Traditional Name: benzenesulfonic acid [2-(2-amino-1-hydroxy-2-keto-ethyl)phenyl] ester Formula: C14H13NO5S MolecularWeight: 307.32172

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC=C2C(C(=O)N)O

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC=C2C(C(=O)N)O

InChI

InChI=1S/C14H13NO5S/c15-14(17)13(16)11-8-4-5-9-12(11)20-21(18,19)10-6-2-1-3-7-10/h1-9,13,16H,(H2,15,17)