2-[(4-chloranyl-3-methylsulfonyl-phenyl)carbonyl-methyl-amino]ethanoic acid

Systemtic Name: 2-[(4-chloranyl-3-methylsulfonyl-phenyl)carbonyl-methyl-amino]ethanoic acid Openeye Name: 2-[(4-chloro-3-methylsulfonyl-benzoyl)-methyl-amino]acetic acid CAS Name: 2-[[(4-chloro-3-methylsulfonylphenyl)-oxomethyl]-methylamino]acetic acid IUPAC Name: 2-[(4-chloro-3-methylsulfonylbenzoyl)-methylamino]acetic acid Traditional Name: 2-[(4-chloro-3-mesyl-benzoyl)-methyl-amino]acetic acid Formula: C11H12ClNO5S MolecularWeight: 305.73468

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12ClNO5S/c1-13(6-10(14)15)11(16)7-3-4-8(12)9(5-7)19(2,17)18/h3-5H,6H2,1-2H3,(H,14,15)