2-[4-(methoxycarbonylamino)phenyl]sulfonylsulfanylethanoic acid

Systemtic Name: 2-[4-(methoxycarbonylamino)phenyl]sulfonylsulfanylethanoic acid Openeye Name: 2-[4-(methoxycarbonylamino)phenyl]sulfonylsulfanylacetic acid CAS Name: 2-[[4-(methoxycarbonylamino)phenyl]sulfonylthio]acetic acid IUPAC Name: 2-[4-(methoxycarbonylamino)phenyl]sulfonylsulfanylacetic acid Traditional Name: 2-[[4-(carbomethoxyamino)phenyl]sulfonylthio]acetic acid Formula: C10H11NO6S2 MolecularWeight: 305.32744

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC1=CC=C(C=C1)S(=O)(=O)SCC(=O)O

Isomeric SMILES

COC(=O)NC1=CC=C(C=C1)S(=O)(=O)SCC(=O)O

InChI

InChI=1S/C10H11NO6S2/c1-17-10(14)11-7-2-4-8(5-3-7)19(15,16)18-6-9(12)13/h2-5H,6H2,1H3,(H,11,14)(H,12,13)