2-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]ethanoate

Systemtic Name: 2-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]ethanoate Openeye Name: 2-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]acetate CAS Name: 2-[(3,4-dimethylphenyl)sulfonyl-methylamino]acetate IUPAC Name: 2-[(3,4-dimethylphenyl)sulfonyl-methylamino]acetate Traditional Name: 2-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]acetate Formula: C11H14NO4S- MolecularWeight: 256.29816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N(C)CC(=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(C)CC(=O)[O-])C

InChI

InChI=1S/C11H15NO4S/c1-8-4-5-10(6-9(8)2)17(15,16)12(3)7-11(13)14/h4-6H,7H2,1-3H3,(H,13,14)/p-1