2-(3-azanyl-4-methoxy-phenyl)sulfonylethyl hydrogen sulfate

Systemtic Name: 2-(3-azanyl-4-methoxy-phenyl)sulfonylethyl hydrogen sulfate Openeye Name: 2-(3-amino-4-methoxy-phenyl)sulfonylethyl hydrogen sulfate CAS Name: sulfuric acid 2-(3-amino-4-methoxyphenyl)sulfonylethyl ester IUPAC Name: 2-(3-amino-4-methoxyphenyl)sulfonylethyl hydrogen sulfate Traditional Name: sulfuric acid 2-(3-amino-4-methoxy-phenyl)sulfonylethyl ester Formula: C9H13NO7S2 MolecularWeight: 311.33202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)CCOS(=O)(=O)O)N

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)CCOS(=O)(=O)O)N

InChI

InChI=1S/C9H13NO7S2/c1-16-9-3-2-7(6-8(9)10)18(11,12)5-4-17-19(13,14)15/h2-3,6H,4-5,10H2,1H3,(H,13,14,15)