methyl 2-azanyl-3-(2-bromanyl-3,4-dimethoxy-phenyl)propanoate

Systemtic Name: methyl 2-azanyl-3-(2-bromanyl-3,4-dimethoxy-phenyl)propanoate Openeye Name: methyl 2-amino-3-(2-bromo-3,4-dimethoxy-phenyl)propanoate CAS Name: 2-amino-3-(2-bromo-3,4-dimethoxyphenyl)propanoic acid methyl ester IUPAC Name: methyl 2-amino-3-(2-bromo-3,4-dimethoxyphenyl)propanoate Traditional Name: 2-amino-3-(2-bromo-3,4-dimethoxy-phenyl)propionic acid methyl ester Formula: C12H16BrNO4 MolecularWeight: 318.16374

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CC(C(=O)OC)N)Br)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)CC(C(=O)OC)N)Br)OC

InChI

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