ethyl 3-azanyl-1,3-benzothiazol-3-ium-2-carboxylate

Systemtic Name: ethyl 3-azanyl-1,3-benzothiazol-3-ium-2-carboxylate Openeye Name: ethyl 3-amino-1,3-benzothiazol-3-ium-2-carboxylate CAS Name: 3-amino-1,3-benzothiazol-3-ium-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-amino-1,3-benzothiazol-3-ium-2-carboxylate Traditional Name: 3-amino-1,3-benzothiazol-3-ium-2-carboxylic acid ethyl ester Formula: C10H11N2O2S+ MolecularWeight: 223.27154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=[N+](C2=CC=CC=C2S1)N

Isomeric SMILES

CCOC(=O)C1=[N+](C2=CC=CC=C2S1)N

InChI

InChI=1S/C10H10N2O2S/c1-2-14-10(13)9-12(11)7-5-3-4-6-8(7)15-9/h3-6H,2H2,1H3,(H-,11,13)/p+1