2-[(4,5-dimethoxy-2-methyl-phenyl)methylamino]ethanoic acid

Systemtic Name: 2-[(4,5-dimethoxy-2-methyl-phenyl)methylamino]ethanoic acid Openeye Name: 2-[(4,5-dimethoxy-2-methyl-phenyl)methylamino]acetic acid CAS Name: 2-[(4,5-dimethoxy-2-methylphenyl)methylamino]acetic acid IUPAC Name: 2-[(4,5-dimethoxy-2-methylphenyl)methylamino]acetic acid Traditional Name: 2-[(4,5-dimethoxy-2-methyl-benzyl)amino]acetic acid Formula: C12H17NO4 MolecularWeight: 239.26768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1CNCC(=O)O)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1CNCC(=O)O)OC)OC

InChI

InChI=1S/C12H17NO4/c1-8-4-10(16-2)11(17-3)5-9(8)6-13-7-12(14)15/h4-5,13H,6-7H2,1-3H3,(H,14,15)