3-azanyl-2-(3-bromanyl-4-methoxy-phenyl)propanoic acid

Systemtic Name: 3-azanyl-2-(3-bromanyl-4-methoxy-phenyl)propanoic acid Openeye Name: 3-amino-2-(3-bromo-4-methoxy-phenyl)propanoic acid CAS Name: 3-amino-2-(3-bromo-4-methoxyphenyl)propanoic acid IUPAC Name: 3-amino-2-(3-bromo-4-methoxyphenyl)propanoic acid Traditional Name: 3-amino-2-(3-bromo-4-methoxy-phenyl)propionic acid Formula: C10H12BrNO3 MolecularWeight: 274.11118

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CN)C(=O)O)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C(CN)C(=O)O)Br

InChI

InChI=1S/C10H12BrNO3/c1-15-9-3-2-6(4-8(9)11)7(5-12)10(13)14/h2-4,7H,5,12H2,1H3,(H,13,14)