3-(4-methylsulfonylphenyl)azanidylsulfonylpropanoate

Systemtic Name: 3-(4-methylsulfonylphenyl)azanidylsulfonylpropanoate Openeye Name: 3-(4-methylsulfonylphenyl)azanidylsulfonylpropanoate CAS Name: 3-(4-methylsulfonylphenyl)azanidylsulfonylpropanoate IUPAC Name: 3-(4-methylsulfonylphenyl)azanidylsulfonylpropanoate Traditional Name: 3-(4-mesylphenyl)azanidylsulfonylpropionate Formula: C10H11NO6S2-2 MolecularWeight: 305.32744

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)[N-]S(=O)(=O)CCC(=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)[N-]S(=O)(=O)CCC(=O)[O-]

InChI

InChI=1S/C10H12NO6S2/c1-18(14,15)9-4-2-8(3-5-9)11-19(16,17)7-6-10(12)13/h2-5H,6-7H2,1H3,(H,12,13)/q-1/p-1