3-[1-(3-bromanyl-4-methoxy-phenyl)ethylamino]propanoic acid

Systemtic Name: 3-[1-(3-bromanyl-4-methoxy-phenyl)ethylamino]propanoic acid Openeye Name: 3-[1-(3-bromo-4-methoxy-phenyl)ethylamino]propanoic acid CAS Name: 3-[1-(3-bromo-4-methoxyphenyl)ethylamino]propanoic acid IUPAC Name: 3-[1-(3-bromo-4-methoxyphenyl)ethylamino]propanoic acid Traditional Name: 3-[1-(3-bromo-4-methoxy-phenyl)ethylamino]propionic acid Formula: C12H16BrNO3 MolecularWeight: 302.16434

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)OC)Br)NCCC(=O)O

Isomeric SMILES

CC(C1=CC(=C(C=C1)OC)Br)NCCC(=O)O

InChI

InChI=1S/C12H16BrNO3/c1-8(14-6-5-12(15)16)9-3-4-11(17-2)10(13)7-9/h3-4,7-8,14H,5-6H2,1-2H3,(H,15,16)