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

Systemtic Name: 4-[1,1-bis(oxidanylidene)-1,4-thiazinan-4-yl]-5-chloranyl-2-methoxy-benzoic acid Openeye Name: 5-chloro-4-(1,1-dioxo-1,4-thiazinan-4-yl)-2-methoxy-benzoic acid CAS Name: 5-chloro-4-(1,1-dioxo-1,4-thiazinan-4-yl)-2-methoxybenzoic acid IUPAC Name: 5-chloro-4-(1,1-dioxo-1,4-thiazinan-4-yl)-2-methoxybenzoic acid Traditional Name: 5-chloro-4-(1,1-diketo-1,4-thiazinan-4-yl)-2-methoxy-benzoic acid Formula: C12H14ClNO5S MolecularWeight: 319.76126

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)O)Cl)N2CCS(=O)(=O)CC2

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)O)Cl)N2CCS(=O)(=O)CC2

InChI

InChI=1S/C12H14ClNO5S/c1-19-11-7-10(9(13)6-8(11)12(15)16)14-2-4-20(17,18)5-3-14/h6-7H,2-5H2,1H3,(H,15,16)