2-[2-azanyl-1-(1,3-benzodioxol-5-yl)-2-oxidanylidene-ethyl]sulfinylethanoic acid

Systemtic Name: 2-[2-azanyl-1-(1,3-benzodioxol-5-yl)-2-oxidanylidene-ethyl]sulfinylethanoic acid Openeye Name: 2-[2-amino-1-(1,3-benzodioxol-5-yl)-2-oxo-ethyl]sulfinylacetic acid CAS Name: 2-[2-amino-1-(1,3-benzodioxol-5-yl)-2-oxoethyl]sulfinylacetic acid IUPAC Name: 2-[2-amino-1-(1,3-benzodioxol-5-yl)-2-oxoethyl]sulfinylacetic acid Traditional Name: 2-[2-amino-1-(1,3-benzodioxol-5-yl)-2-keto-ethyl]sulfinylacetic acid Formula: C11H11NO6S MolecularWeight: 285.27314

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(C(=O)N)S(=O)CC(=O)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(C(=O)N)S(=O)CC(=O)O

InChI

InChI=1S/C11H11NO6S/c12-11(15)10(19(16)4-9(13)14)6-1-2-7-8(3-6)18-5-17-7/h1-3,10H,4-5H2,(H2,12,15)(H,13,14)