3-(2,3-dimethyl-1,3-benzothiazol-2-yl)propanoic acid

Systemtic Name: 3-(2,3-dimethyl-1,3-benzothiazol-2-yl)propanoic acid Openeye Name: 3-(2,3-dimethyl-1,3-benzothiazol-2-yl)propanoic acid CAS Name: 3-(2,3-dimethyl-1,3-benzothiazol-2-yl)propanoic acid IUPAC Name: 3-(2,3-dimethyl-1,3-benzothiazol-2-yl)propanoic acid Traditional Name: 3-(2,3-dimethyl-1,3-benzothiazol-2-yl)propionic acid Formula: C12H15NO2S MolecularWeight: 237.318

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Descriptors Computed from Structure

Canonical SMILES:

CC1(N(C2=CC=CC=C2S1)C)CCC(=O)O

Isomeric SMILES

CC1(N(C2=CC=CC=C2S1)C)CCC(=O)O

InChI

InChI=1S/C12H15NO2S/c1-12(8-7-11(14)15)13(2)9-5-3-4-6-10(9)16-12/h3-6H,7-8H2,1-2H3,(H,14,15)