5-acetamido-2-[1,1-bis(oxidanylidene)-1,4-thiazinan-4-yl]benzoic acid

Systemtic Name: 5-acetamido-2-[1,1-bis(oxidanylidene)-1,4-thiazinan-4-yl]benzoic acid Openeye Name: 5-acetamido-2-(1,1-dioxo-1,4-thiazinan-4-yl)benzoic acid CAS Name: 5-acetamido-2-(1,1-dioxo-1,4-thiazinan-4-yl)benzoic acid IUPAC Name: 5-acetamido-2-(1,1-dioxo-1,4-thiazinan-4-yl)benzoic acid Traditional Name: 5-acetamido-2-(1,1-diketo-1,4-thiazinan-4-yl)benzoic acid Formula: C13H16N2O5S MolecularWeight: 312.34154

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)N2CCS(=O)(=O)CC2)C(=O)O

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)N2CCS(=O)(=O)CC2)C(=O)O

InChI

InChI=1S/C13H16N2O5S/c1-9(16)14-10-2-3-12(11(8-10)13(17)18)15-4-6-21(19,20)7-5-15/h2-3,8H,4-7H2,1H3,(H,14,16)(H,17,18)