propan-2-yl (4Z)-4-[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-ylidene]-3-oxidanylidene-butanoate

Systemtic Name: propan-2-yl (4Z)-4-[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-ylidene]-3-oxidanylidene-butanoate Openeye Name: isopropyl (4Z)-4-(1,1-dioxo-1,2-benzothiazol-3-ylidene)-3-oxo-butanoate CAS Name: (4Z)-4-(1,1-dioxo-1,2-benzothiazol-3-ylidene)-3-oxobutanoic acid propan-2-yl ester IUPAC Name: propan-2-yl (4Z)-4-(1,1-dioxo-1,2-benzothiazol-3-ylidene)-3-oxobutanoate Traditional Name: (4Z)-4-(1,1-diketo-1,2-benzothiazol-3-ylidene)-3-keto-butyric acid isopropyl ester Formula: C14H15NO5S MolecularWeight: 309.3376

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CC(=O)C=C1C2=CC=CC=C2S(=O)(=O)N1

Isomeric SMILES

CC(C)OC(=O)CC(=O)/C=C\1/C2=CC=CC=C2S(=O)(=O)N1

InChI

InChI=1S/C14H15NO5S/c1-9(2)20-14(17)8-10(16)7-12-11-5-3-4-6-13(11)21(18,19)15-12/h3-7,9,15H,8H2,1-2H3/b12-7-