methyl 2-(2-methylcyclohexyl)-1,1,3-tris(oxidanylidene)-1,2-benzothiazole-6-carboxylate

Systemtic Name: methyl 2-(2-methylcyclohexyl)-1,1,3-tris(oxidanylidene)-1,2-benzothiazole-6-carboxylate Openeye Name: methyl 2-(2-methylcyclohexyl)-1,1,3-trioxo-1,2-benzothiazole-6-carboxylate CAS Name: 2-(2-methylcyclohexyl)-1,1,3-trioxo-1,2-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 2-(2-methylcyclohexyl)-1,1,3-trioxo-1,2-benzothiazole-6-carboxylate Traditional Name: 1,1,3-triketo-2-(2-methylcyclohexyl)-1,2-benzothiazole-6-carboxylic acid methyl ester Formula: C16H19NO5S MolecularWeight: 337.39076

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1N2C(=O)C3=C(S2(=O)=O)C=C(C=C3)C(=O)OC

Isomeric SMILES

CC1CCCCC1N2C(=O)C3=C(S2(=O)=O)C=C(C=C3)C(=O)OC

InChI

InChI=1S/C16H19NO5S/c1-10-5-3-4-6-13(10)17-15(18)12-8-7-11(16(19)22-2)9-14(12)23(17,20)21/h7-10,13H,3-6H2,1-2H3