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

Systemtic Name: 2-[(2-chloranyl-3-methyl-phenyl)methylsulfonyl-methyl-amino]ethanoic acid Openeye Name: 2-[(2-chloro-3-methyl-phenyl)methylsulfonyl-methyl-amino]acetic acid CAS Name: 2-[(2-chloro-3-methylphenyl)methylsulfonyl-methylamino]acetic acid IUPAC Name: 2-[(2-chloro-3-methylphenyl)methylsulfonyl-methylamino]acetic acid Traditional Name: 2-[(2-chloro-3-methyl-benzyl)sulfonyl-methyl-amino]acetic acid Formula: C11H14ClNO4S MolecularWeight: 291.75116

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)CS(=O)(=O)N(C)CC(=O)O)Cl

Isomeric SMILES

CC1=C(C(=CC=C1)CS(=O)(=O)N(C)CC(=O)O)Cl

InChI

InChI=1S/C11H14ClNO4S/c1-8-4-3-5-9(11(8)12)7-18(16,17)13(2)6-10(14)15/h3-5H,6-7H2,1-2H3,(H,14,15)