[2-oxidanylidene-2-(2,4,5-trimethylphenyl)ethyl] 1,3-benzothiazole-6-carboxylate

Systemtic Name: [2-oxidanylidene-2-(2,4,5-trimethylphenyl)ethyl] 1,3-benzothiazole-6-carboxylate Openeye Name: [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] 1,3-benzothiazole-6-carboxylate CAS Name: 1,3-benzothiazole-6-carboxylic acid [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] 1,3-benzothiazole-6-carboxylate Traditional Name: 1,3-benzothiazole-6-carboxylic acid [2-keto-2-(2,4,5-trimethylphenyl)ethyl] ester Formula: C19H17NO3S MolecularWeight: 339.40818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)COC(=O)C2=CC3=C(C=C2)N=CS3)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)COC(=O)C2=CC3=C(C=C2)N=CS3)C)C

InChI

InChI=1S/C19H17NO3S/c1-11-6-13(3)15(7-12(11)2)17(21)9-23-19(22)14-4-5-16-18(8-14)24-10-20-16/h4-8,10H,9H2,1-3H3