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

Systemtic Name: 2-[(4-bromanyl-2,5-dimethoxy-phenyl)methyl-methyl-amino]ethanoic acid Openeye Name: 2-[(4-bromo-2,5-dimethoxy-phenyl)methyl-methyl-amino]acetic acid CAS Name: 2-[(4-bromo-2,5-dimethoxyphenyl)methyl-methylamino]acetic acid IUPAC Name: 2-[(4-bromo-2,5-dimethoxyphenyl)methyl-methylamino]acetic acid Traditional Name: 2-[(4-bromo-2,5-dimethoxy-benzyl)-methyl-amino]acetic acid Formula: C12H16BrNO4 MolecularWeight: 318.16374

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=C(C=C1OC)Br)OC)CC(=O)O

Isomeric SMILES

CN(CC1=CC(=C(C=C1OC)Br)OC)CC(=O)O

InChI

InChI=1S/C12H16BrNO4/c1-14(7-12(15)16)6-8-4-11(18-3)9(13)5-10(8)17-2/h4-5H,6-7H2,1-3H3,(H,15,16)