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

Systemtic Name: 2-(3-azanyl-4-methoxy-phenyl)sulfonylethyl sulfate Openeye Name: 2-(3-amino-4-methoxy-phenyl)sulfonylethyl sulfate CAS Name: 2-(3-amino-4-methoxyphenyl)sulfonylethyl sulfate IUPAC Name: 2-(3-amino-4-methoxyphenyl)sulfonylethyl sulfate Traditional Name: 2-(3-amino-4-methoxy-phenyl)sulfonylethyl sulfate Formula: C9H12NO7S2- MolecularWeight: 310.32408

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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)/p-1