2-(1,3-benzothiazol-2-ylmethyl)-2,3-dimethyl-butanoic acid

Systemtic Name: 2-(1,3-benzothiazol-2-ylmethyl)-2,3-dimethyl-butanoic acid Openeye Name: 2-(1,3-benzothiazol-2-ylmethyl)-2,3-dimethyl-butanoic acid CAS Name: 2-(1,3-benzothiazol-2-ylmethyl)-2,3-dimethylbutanoic acid IUPAC Name: 2-(1,3-benzothiazol-2-ylmethyl)-2,3-dimethylbutanoic acid Traditional Name: 2-(1,3-benzothiazol-2-ylmethyl)-2,3-dimethyl-butyric acid Formula: C14H17NO2S MolecularWeight: 263.35528

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)(CC1=NC2=CC=CC=C2S1)C(=O)O

Isomeric SMILES

CC(C)C(C)(CC1=NC2=CC=CC=C2S1)C(=O)O

InChI

InChI=1S/C14H17NO2S/c1-9(2)14(3,13(16)17)8-12-15-10-6-4-5-7-11(10)18-12/h4-7,9H,8H2,1-3H3,(H,16,17)