sodium 3-(1,3-benzothiazol-2-yl)propanoate

Systemtic Name: sodium 3-(1,3-benzothiazol-2-yl)propanoate Openeye Name: sodium 3-(1,3-benzothiazol-2-yl)propanoate CAS Name: sodium 3-(1,3-benzothiazol-2-yl)propanoate IUPAC Name: sodium 3-(1,3-benzothiazol-2-yl)propanoate Traditional Name: sodium 3-(1,3-benzothiazol-2-yl)propionate Formula: C10H8NNaO2S MolecularWeight: 229.23079

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)CCC(=O)[O-].[Na+]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)CCC(=O)[O-].[Na+]

InChI

InChI=1S/C10H9NO2S.Na/c12-10(13)6-5-9-11-7-3-1-2-4-8(7)14-9;/h1-4H,5-6H2,(H,12,13);/q;+1/p-1