sodium 2-(1,3-benzothiazol-2-ylamino)ethanoate

Systemtic Name: sodium 2-(1,3-benzothiazol-2-ylamino)ethanoate Openeye Name: sodium 2-(1,3-benzothiazol-2-ylamino)acetate CAS Name: sodium 2-(1,3-benzothiazol-2-ylamino)acetate IUPAC Name: sodium 2-(1,3-benzothiazol-2-ylamino)acetate Traditional Name: sodium 2-(1,3-benzothiazol-2-ylamino)acetate Formula: C9H7N2NaO2S MolecularWeight: 230.21885

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H8N2O2S.Na/c12-8(13)5-10-9-11-6-3-1-2-4-7(6)14-9;/h1-4H,5H2,(H,10,11)(H,12,13);/q;+1/p-1