2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)ethanoic acid

Systemtic Name: 2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)ethanoic acid Openeye Name: 2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetic acid CAS Name: 2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetic acid IUPAC Name: 2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetic acid Traditional Name: 2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetic acid Formula: C9H11NO2S MolecularWeight: 197.25414

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)N=C(S2)CC(=O)O

Isomeric SMILES

C1CCC2=C(C1)N=C(S2)CC(=O)O

InChI

InChI=1S/C9H11NO2S/c11-9(12)5-8-10-6-3-1-2-4-7(6)13-8/h1-5H2,(H,11,12)