[2-(2-methoxyethylamino)-2-oxidanylidene-ethyl] 4-(1,3-benzothiazol-2-yl)butanoate

Systemtic Name: [2-(2-methoxyethylamino)-2-oxidanylidene-ethyl] 4-(1,3-benzothiazol-2-yl)butanoate Openeye Name: [2-(2-methoxyethylamino)-2-oxo-ethyl] 4-(1,3-benzothiazol-2-yl)butanoate CAS Name: 4-(1,3-benzothiazol-2-yl)butanoic acid [2-(2-methoxyethylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-methoxyethylamino)-2-oxoethyl] 4-(1,3-benzothiazol-2-yl)butanoate Traditional Name: 4-(1,3-benzothiazol-2-yl)butyric acid [2-keto-2-(2-methoxyethylamino)ethyl] ester Formula: C16H20N2O4S MolecularWeight: 336.406

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC(=O)COC(=O)CCCC1=NC2=CC=CC=C2S1

Isomeric SMILES

COCCNC(=O)COC(=O)CCCC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C16H20N2O4S/c1-21-10-9-17-14(19)11-22-16(20)8-4-7-15-18-12-5-2-3-6-13(12)23-15/h2-3,5-6H,4,7-11H2,1H3,(H,17,19)