2-(6-ethylsulfonyl-2-oxidanylidene-3H-1,4-benzoxazin-4-yl)ethanoic acid

Systemtic Name: 2-(6-ethylsulfonyl-2-oxidanylidene-3H-1,4-benzoxazin-4-yl)ethanoic acid Openeye Name: 2-(6-ethylsulfonyl-2-oxo-3H-1,4-benzoxazin-4-yl)acetic acid CAS Name: 2-(6-ethylsulfonyl-2-oxo-3H-1,4-benzoxazin-4-yl)acetic acid IUPAC Name: 2-(6-ethylsulfonyl-2-oxo-3H-1,4-benzoxazin-4-yl)acetic acid Traditional Name: 2-(6-esyl-2-keto-3H-1,4-benzoxazin-4-yl)acetic acid Formula: C12H13NO6S MolecularWeight: 299.29972

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC2=C(C=C1)OC(=O)CN2CC(=O)O

Isomeric SMILES

CCS(=O)(=O)C1=CC2=C(C=C1)OC(=O)CN2CC(=O)O

InChI

InChI=1S/C12H13NO6S/c1-2-20(17,18)8-3-4-10-9(5-8)13(6-11(14)15)7-12(16)19-10/h3-5H,2,6-7H2,1H3,(H,14,15)