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

Systemtic Name: 2-[2-[(2-chloranylethanoylamino)methyl]-4,5-dimethoxy-phenyl]ethanoic acid Openeye Name: 2-[2-[[(2-chloroacetyl)amino]methyl]-4,5-dimethoxy-phenyl]acetic acid CAS Name: 2-[2-[[(2-chloro-1-oxoethyl)amino]methyl]-4,5-dimethoxyphenyl]acetic acid IUPAC Name: 2-[2-[[(2-chloroacetyl)amino]methyl]-4,5-dimethoxyphenyl]acetic acid Traditional Name: 2-[2-[[(2-chloroacetyl)amino]methyl]-4,5-dimethoxy-phenyl]acetic acid Formula: C13H16ClNO5 MolecularWeight: 301.72284

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CC(=O)O)CNC(=O)CCl)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CC(=O)O)CNC(=O)CCl)OC

InChI

InChI=1S/C13H16ClNO5/c1-19-10-3-8(5-13(17)18)9(4-11(10)20-2)7-15-12(16)6-14/h3-4H,5-7H2,1-2H3,(H,15,16)(H,17,18)