methyl 3-morpholin-4-yl-1,1-bis(oxidanylidene)-1,2-benzothiazole-6-carboxylate

Systemtic Name: methyl 3-morpholin-4-yl-1,1-bis(oxidanylidene)-1,2-benzothiazole-6-carboxylate Openeye Name: methyl 3-morpholino-1,1-dioxo-1,2-benzothiazole-6-carboxylate CAS Name: 3-(4-morpholinyl)-1,1-dioxo-1,2-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 3-morpholin-4-yl-1,1-dioxo-1,2-benzothiazole-6-carboxylate Traditional Name: 1,1-diketo-3-morpholino-1,2-benzothiazole-6-carboxylic acid methyl ester Formula: C13H14N2O5S MolecularWeight: 310.32566

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=NS2(=O)=O)N3CCOCC3

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=NS2(=O)=O)N3CCOCC3

InChI

InChI=1S/C13H14N2O5S/c1-19-13(16)9-2-3-10-11(8-9)21(17,18)14-12(10)15-4-6-20-7-5-15/h2-3,8H,4-7H2,1H3