2-azanyl-4,5,6,7-tetrahydro-1,3-benzothiazole-6-carboxylate

Systemtic Name: 2-azanyl-4,5,6,7-tetrahydro-1,3-benzothiazole-6-carboxylate Openeye Name: 2-amino-4,5,6,7-tetrahydro-1,3-benzothiazole-6-carboxylate CAS Name: 2-amino-4,5,6,7-tetrahydro-1,3-benzothiazole-6-carboxylate IUPAC Name: 2-amino-4,5,6,7-tetrahydro-1,3-benzothiazole-6-carboxylate Traditional Name: 2-amino-4,5,6,7-tetrahydro-1,3-benzothiazole-6-carboxylate Formula: C8H9N2O2S- MolecularWeight: 197.23426

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(CC1C(=O)[O-])SC(=N2)N

Isomeric SMILES

C1CC2=C(CC1C(=O)[O-])SC(=N2)N

InChI

InChI=1S/C8H10N2O2S/c9-8-10-5-2-1-4(7(11)12)3-6(5)13-8/h4H,1-3H2,(H2,9,10)(H,11,12)/p-1