2-[4-(2-chloranylethanoylamino)phenyl]-1,3-thiazole-4-carboxylic acid

Systemtic Name: 2-[4-(2-chloranylethanoylamino)phenyl]-1,3-thiazole-4-carboxylic acid Openeye Name: 2-[4-[(2-chloroacetyl)amino]phenyl]thiazole-4-carboxylic acid CAS Name: 2-[4-[(2-chloro-1-oxoethyl)amino]phenyl]-4-thiazolecarboxylic acid IUPAC Name: 2-[4-[(2-chloroacetyl)amino]phenyl]-1,3-thiazole-4-carboxylic acid Traditional Name: 2-[4-[(2-chloroacetyl)amino]phenyl]thiazole-4-carboxylic acid Formula: C12H9ClN2O3S MolecularWeight: 296.72946

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC(=CS2)C(=O)O)NC(=O)CCl

Isomeric SMILES

C1=CC(=CC=C1C2=NC(=CS2)C(=O)O)NC(=O)CCl

InChI

InChI=1S/C12H9ClN2O3S/c13-5-10(16)14-8-3-1-7(2-4-8)11-15-9(6-19-11)12(17)18/h1-4,6H,5H2,(H,14,16)(H,17,18)