3-[1,1-bis(oxidanylidene)-1,2-thiazinan-2-yl]-4-methyl-benzoic acid

Systemtic Name: 3-[1,1-bis(oxidanylidene)-1,2-thiazinan-2-yl]-4-methyl-benzoic acid Openeye Name: 3-(1,1-dioxothiazinan-2-yl)-4-methyl-benzoic acid CAS Name: 3-(1,1-dioxo-2-thiazinanyl)-4-methylbenzoic acid IUPAC Name: 3-(1,1-dioxothiazinan-2-yl)-4-methylbenzoic acid Traditional Name: 3-(1,1-diketothiazinan-2-yl)-4-methyl-benzoic acid Formula: C12H15NO4S MolecularWeight: 269.3168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)N2CCCCS2(=O)=O

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)N2CCCCS2(=O)=O

InChI

InChI=1S/C12H15NO4S/c1-9-4-5-10(12(14)15)8-11(9)13-6-2-3-7-18(13,16)17/h4-5,8H,2-3,6-7H2,1H3,(H,14,15)