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

Systemtic Name: 3-azanyl-3-(1,3-benzothiazol-2-yl)propanoate Openeye Name: 3-amino-3-(1,3-benzothiazol-2-yl)propanoate CAS Name: 3-amino-3-(1,3-benzothiazol-2-yl)propanoate IUPAC Name: 3-amino-3-(1,3-benzothiazol-2-yl)propanoate Traditional Name: 3-amino-3-(1,3-benzothiazol-2-yl)propionate Formula: C10H9N2O2S- MolecularWeight: 221.25566

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C(CC(=O)[O-])N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C(CC(=O)[O-])N

InChI

InChI=1S/C10H10N2O2S/c11-6(5-9(13)14)10-12-7-3-1-2-4-8(7)15-10/h1-4,6H,5,11H2,(H,13,14)/p-1