2-[2-(2,5-dimethylphenyl)-2-oxidanylidene-ethyl]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one

Systemtic Name: 2-[2-(2,5-dimethylphenyl)-2-oxidanylidene-ethyl]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one Openeye Name: 2-[2-(2,5-dimethylphenyl)-2-oxo-ethyl]-1,1-dioxo-1,2-benzothiazol-3-one CAS Name: 2-[2-(2,5-dimethylphenyl)-2-oxoethyl]-1,1-dioxo-1,2-benzothiazol-3-one IUPAC Name: 2-[2-(2,5-dimethylphenyl)-2-oxoethyl]-1,1-dioxo-1,2-benzothiazol-3-one Traditional Name: 2-[2-(2,5-dimethylphenyl)-2-keto-ethyl]-1,1-diketo-1,2-benzothiazol-3-one Formula: C17H15NO4S MolecularWeight: 329.3703

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(=O)CN2C(=O)C3=CC=CC=C3S2(=O)=O

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(=O)CN2C(=O)C3=CC=CC=C3S2(=O)=O

InChI

InChI=1S/C17H15NO4S/c1-11-7-8-12(2)14(9-11)15(19)10-18-17(20)13-5-3-4-6-16(13)23(18,21)22/h3-9H,10H2,1-2H3