2-[(4-chloranyl-3-methylsulfonyl-phenyl)carbonylamino]propanoic acid

Systemtic Name: 2-[(4-chloranyl-3-methylsulfonyl-phenyl)carbonylamino]propanoic acid Openeye Name: 2-[(4-chloro-3-methylsulfonyl-benzoyl)amino]propanoic acid CAS Name: 2-[[(4-chloro-3-methylsulfonylphenyl)-oxomethyl]amino]propanoic acid IUPAC Name: 2-[(4-chloro-3-methylsulfonylbenzoyl)amino]propanoic acid Traditional Name: 2-[(4-chloro-3-mesyl-benzoyl)amino]propionic acid Formula: C11H12ClNO5S MolecularWeight: 305.73468

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)C

Isomeric SMILES

CC(C(=O)O)NC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)C

InChI

InChI=1S/C11H12ClNO5S/c1-6(11(15)16)13-10(14)7-3-4-8(12)9(5-7)19(2,17)18/h3-6H,1-2H3,(H,13,14)(H,15,16)