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

Systemtic Name: sodium 3-(1,3-benzothiazol-2-yl)-3-methoxy-propanoate Openeye Name: sodium 3-(1,3-benzothiazol-2-yl)-3-methoxy-propanoate CAS Name: sodium 3-(1,3-benzothiazol-2-yl)-3-methoxypropanoate IUPAC Name: sodium 3-(1,3-benzothiazol-2-yl)-3-methoxypropanoate Traditional Name: sodium 3-(1,3-benzothiazol-2-yl)-3-methoxy-propionate Formula: C11H10NNaO3S MolecularWeight: 259.25677

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(CC(=O)[O-])C1=NC2=CC=CC=C2S1.[Na+]

Isomeric SMILES

COC(CC(=O)[O-])C1=NC2=CC=CC=C2S1.[Na+]

InChI

InChI=1S/C11H11NO3S.Na/c1-15-8(6-10(13)14)11-12-7-4-2-3-5-9(7)16-11;/h2-5,8H,6H2,1H3,(H,13,14);/q;+1/p-1