4-chloranyl-1,1-bis(oxidanylidene)-2-(2-oxidanylidenepropyl)-1,2-benzothiazol-3-one

Systemtic Name: 4-chloranyl-1,1-bis(oxidanylidene)-2-(2-oxidanylidenepropyl)-1,2-benzothiazol-3-one Openeye Name: 2-acetonyl-4-chloro-1,1-dioxo-1,2-benzothiazol-3-one CAS Name: 4-chloro-1,1-dioxo-2-(2-oxopropyl)-1,2-benzothiazol-3-one IUPAC Name: 4-chloro-1,1-dioxo-2-(2-oxopropyl)-1,2-benzothiazol-3-one Traditional Name: 2-acetonyl-4-chloro-1,1-diketo-1,2-benzothiazol-3-one Formula: C10H8ClNO4S MolecularWeight: 273.69282

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CN1C(=O)C2=C(S1(=O)=O)C=CC=C2Cl

Isomeric SMILES

CC(=O)CN1C(=O)C2=C(S1(=O)=O)C=CC=C2Cl

InChI

InChI=1S/C10H8ClNO4S/c1-6(13)5-12-10(14)9-7(11)3-2-4-8(9)17(12,15)16/h2-4H,5H2,1H3