5-(2-azanyl-1-oxidanyl-3-phenyl-propyl)-1,2-thiazole-4-carboxylic acid

Systemtic Name: 5-(2-azanyl-1-oxidanyl-3-phenyl-propyl)-1,2-thiazole-4-carboxylic acid Openeye Name: 5-(2-amino-1-hydroxy-3-phenyl-propyl)isothiazole-4-carboxylic acid CAS Name: 5-(2-amino-1-hydroxy-3-phenylpropyl)-4-isothiazolecarboxylic acid IUPAC Name: 5-(2-amino-1-hydroxy-3-phenylpropyl)-1,2-thiazole-4-carboxylic acid Traditional Name: 5-(2-amino-1-hydroxy-3-phenyl-propyl)isothiazole-4-carboxylic acid Formula: C13H14N2O3S MolecularWeight: 278.32686

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(C2=C(C=NS2)C(=O)O)O)N

Isomeric SMILES

C1=CC=C(C=C1)CC(C(C2=C(C=NS2)C(=O)O)O)N

InChI

InChI=1S/C13H14N2O3S/c14-10(6-8-4-2-1-3-5-8)11(16)12-9(13(17)18)7-15-19-12/h1-5,7,10-11,16H,6,14H2,(H,17,18)