2-[(4-ethoxy-3-methyl-phenyl)sulfonyl-methyl-amino]ethanoic acid

Systemtic Name: 2-[(4-ethoxy-3-methyl-phenyl)sulfonyl-methyl-amino]ethanoic acid Openeye Name: 2-[(4-ethoxy-3-methyl-phenyl)sulfonyl-methyl-amino]acetic acid CAS Name: 2-[(4-ethoxy-3-methylphenyl)sulfonyl-methylamino]acetic acid IUPAC Name: 2-[(4-ethoxy-3-methylphenyl)sulfonyl-methylamino]acetic acid Traditional Name: 2-[(4-ethoxy-3-methyl-phenyl)sulfonyl-methyl-amino]acetic acid Formula: C12H17NO5S MolecularWeight: 287.33208

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)N(C)CC(=O)O)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)N(C)CC(=O)O)C

InChI

InChI=1S/C12H17NO5S/c1-4-18-11-6-5-10(7-9(11)2)19(16,17)13(3)8-12(14)15/h5-7H,4,8H2,1-3H3,(H,14,15)