2-(1,3-benzothiazol-6-ylcarbonylamino)-3-oxidanyl-propanoic acid

Systemtic Name: 2-(1,3-benzothiazol-6-ylcarbonylamino)-3-oxidanyl-propanoic acid Openeye Name: 2-(1,3-benzothiazole-6-carbonylamino)-3-hydroxy-propanoic acid CAS Name: 2-[[1,3-benzothiazol-6-yl(oxo)methyl]amino]-3-hydroxypropanoic acid IUPAC Name: 2-(1,3-benzothiazole-6-carbonylamino)-3-hydroxypropanoic acid Traditional Name: 2-(1,3-benzothiazole-6-carbonylamino)-3-hydroxy-propionic acid Formula: C11H10N2O4S MolecularWeight: 266.2731

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(=O)NC(CO)C(=O)O)SC=N2

Isomeric SMILES

C1=CC2=C(C=C1C(=O)NC(CO)C(=O)O)SC=N2

InChI

InChI=1S/C11H10N2O4S/c14-4-8(11(16)17)13-10(15)6-1-2-7-9(3-6)18-5-12-7/h1-3,5,8,14H,4H2,(H,13,15)(H,16,17)