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3-azanyl-3-(2-oxidanylidene-3H-1,3-benzothiazol-6-yl)propanoic acid

3-azanyl-3-(2-oxidanylidene-3H-1,3-benzothiazol-6-yl)propanoic acid

Systemtic Name:3-azanyl-3-(2-oxidanylidene-3H-1,3-benzothiazol-6-yl)propanoic acid
Openeye Name:3-amino-3-(2-oxo-3H-1,3-benzothiazol-6-yl)propanoic acid
CAS Name:3-amino-3-(2-oxo-3H-1,3-benzothiazol-6-yl)propanoic acid
IUPAC Name:3-amino-3-(2-oxo-3H-1,3-benzothiazol-6-yl)propanoic acid
Traditional Name:3-amino-3-(2-keto-3H-1,3-benzothiazol-6-yl)propionic acid
Formula: C10H10N2O3S
MolecularWeight: 238.263
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(CC(=O)O)N)SC(=O)N2


Isomeric SMILES

C1=CC2=C(C=C1C(CC(=O)O)N)SC(=O)N2


InChI

InChI=1S/C10H10N2O3S/c11-6(4-9(13)14)5-1-2-7-8(3-5)16-10(15)12-7/h1-3,6H,4,11H2,(H,12,15)(H,13,14)


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