methyl 4-(1,3-benzothiazol-2-yl)-2,4-bis(oxidanylidene)butanoate

Systemtic Name: methyl 4-(1,3-benzothiazol-2-yl)-2,4-bis(oxidanylidene)butanoate Openeye Name: methyl 4-(1,3-benzothiazol-2-yl)-2,4-dioxo-butanoate CAS Name: 4-(1,3-benzothiazol-2-yl)-2,4-dioxobutanoic acid methyl ester IUPAC Name: methyl 4-(1,3-benzothiazol-2-yl)-2,4-dioxobutanoate Traditional Name: 4-(1,3-benzothiazol-2-yl)-2,4-diketo-butyric acid methyl ester Formula: C12H9NO4S MolecularWeight: 263.26916

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=O)CC(=O)C1=NC2=CC=CC=C2S1

Isomeric SMILES

COC(=O)C(=O)CC(=O)C1=NC2=CC=CC=C2S1

InChI

InChI=1S/C12H9NO4S/c1-17-12(16)9(15)6-8(14)11-13-7-4-2-3-5-10(7)18-11/h2-5H,6H2,1H3