methyl 3-[[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]methyl]furan-2-carboxylate

Systemtic Name: methyl 3-[[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]methyl]furan-2-carboxylate Openeye Name: methyl 3-[(1,1,3-trioxo-1,2-benzothiazol-2-yl)methyl]furan-2-carboxylate CAS Name: 3-[(1,1,3-trioxo-1,2-benzothiazol-2-yl)methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 3-[(1,1,3-trioxo-1,2-benzothiazol-2-yl)methyl]furan-2-carboxylate Traditional Name: 3-[(1,1,3-triketo-1,2-benzothiazol-2-yl)methyl]furan-2-carboxylic acid methyl ester Formula: C14H11NO6S MolecularWeight: 321.30524

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CO1)CN2C(=O)C3=CC=CC=C3S2(=O)=O

Isomeric SMILES

COC(=O)C1=C(C=CO1)CN2C(=O)C3=CC=CC=C3S2(=O)=O

InChI

InChI=1S/C14H11NO6S/c1-20-14(17)12-9(6-7-21-12)8-15-13(16)10-4-2-3-5-11(10)22(15,18)19/h2-7H,8H2,1H3