2-[(3-methoxy-3-oxidanylidene-propyl)amino]-6-oxidanyl-benzenesulfonate

Systemtic Name: 2-[(3-methoxy-3-oxidanylidene-propyl)amino]-6-oxidanyl-benzenesulfonate Openeye Name: 2-hydroxy-6-[(3-methoxy-3-oxo-propyl)amino]benzenesulfonate CAS Name: 2-hydroxy-6-[(3-methoxy-3-oxopropyl)amino]benzenesulfonate IUPAC Name: 2-hydroxy-6-[(3-methoxy-3-oxopropyl)amino]benzenesulfonate Traditional Name: 2-hydroxy-6-[(3-keto-3-methoxy-propyl)amino]besylate Formula: C10H12NO6S- MolecularWeight: 274.27038

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCNC1=C(C(=CC=C1)O)S(=O)(=O)[O-]

Isomeric SMILES

COC(=O)CCNC1=C(C(=CC=C1)O)S(=O)(=O)[O-]

InChI

InChI=1S/C10H13NO6S/c1-17-9(13)5-6-11-7-3-2-4-8(12)10(7)18(14,15)16/h2-4,11-12H,5-6H2,1H3,(H,14,15,16)/p-1