ethyl (3S)-3-(2-methyl-1,3-benzothiazol-6-yl)-3-oxidanyl-propanoate

Systemtic Name: ethyl (3S)-3-(2-methyl-1,3-benzothiazol-6-yl)-3-oxidanyl-propanoate Openeye Name: ethyl (3S)-3-hydroxy-3-(2-methyl-1,3-benzothiazol-6-yl)propanoate CAS Name: (3S)-3-hydroxy-3-(2-methyl-1,3-benzothiazol-6-yl)propanoic acid ethyl ester IUPAC Name: ethyl (3S)-3-hydroxy-3-(2-methyl-1,3-benzothiazol-6-yl)propanoate Traditional Name: (3S)-3-hydroxy-3-(2-methyl-1,3-benzothiazol-6-yl)propionic acid ethyl ester Formula: C13H15NO3S MolecularWeight: 265.3281

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C1=CC2=C(C=C1)N=C(S2)C)O

Isomeric SMILES

CCOC(=O)C[C@@H](C1=CC2=C(C=C1)N=C(S2)C)O

InChI

InChI=1S/C13H15NO3S/c1-3-17-13(16)7-11(15)9-4-5-10-12(6-9)18-8(2)14-10/h4-6,11,15H,3,7H2,1-2H3/t11-/m0/s1