2-azanyl-3-(2-methyl-4-oxidanyl-1,3-benzothiazol-6-yl)propanoic acid

Systemtic Name: 2-azanyl-3-(2-methyl-4-oxidanyl-1,3-benzothiazol-6-yl)propanoic acid Openeye Name: 2-amino-3-(4-hydroxy-2-methyl-1,3-benzothiazol-6-yl)propanoic acid CAS Name: 2-amino-3-(4-hydroxy-2-methyl-1,3-benzothiazol-6-yl)propanoic acid IUPAC Name: 2-amino-3-(4-hydroxy-2-methyl-1,3-benzothiazol-6-yl)propanoic acid Traditional Name: 2-amino-3-(4-hydroxy-2-methyl-1,3-benzothiazol-6-yl)propionic acid Formula: C11H12N2O3S MolecularWeight: 252.28958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2S1)CC(C(=O)O)N)O

Isomeric SMILES

CC1=NC2=C(C=C(C=C2S1)CC(C(=O)O)N)O

InChI

InChI=1S/C11H12N2O3S/c1-5-13-10-8(14)3-6(4-9(10)17-5)2-7(12)11(15)16/h3-4,7,14H,2,12H2,1H3,(H,15,16)