2-(4-butyl-2-oxidanylidene-1,3-benzothiazol-3-yl)ethanoic acid

Systemtic Name: 2-(4-butyl-2-oxidanylidene-1,3-benzothiazol-3-yl)ethanoic acid Openeye Name: 2-(4-butyl-2-oxo-1,3-benzothiazol-3-yl)acetic acid CAS Name: 2-(4-butyl-2-oxo-1,3-benzothiazol-3-yl)acetic acid IUPAC Name: 2-(4-butyl-2-oxo-1,3-benzothiazol-3-yl)acetic acid Traditional Name: 2-(4-butyl-2-keto-1,3-benzothiazol-3-yl)acetic acid Formula: C13H15NO3S MolecularWeight: 265.3281

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C2C(=CC=C1)SC(=O)N2CC(=O)O

Isomeric SMILES

CCCCC1=C2C(=CC=C1)SC(=O)N2CC(=O)O

InChI

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