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3-[(3-bromanyl-5-methoxy-4-propoxy-phenyl)methylamino]propanoic acid

3-[(3-bromanyl-5-methoxy-4-propoxy-phenyl)methylamino]propanoic acid

Systemtic Name:3-[(3-bromanyl-5-methoxy-4-propoxy-phenyl)methylamino]propanoic acid
Openeye Name:3-[(3-bromo-5-methoxy-4-propoxy-phenyl)methylamino]propanoic acid
CAS Name:3-[(3-bromo-5-methoxy-4-propoxyphenyl)methylamino]propanoic acid
IUPAC Name:3-[(3-bromo-5-methoxy-4-propoxyphenyl)methylamino]propanoic acid
Traditional Name:3-[(3-bromo-5-methoxy-4-propoxy-benzyl)amino]propionic acid
Formula: C14H20BrNO4
MolecularWeight: 346.2169
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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Br)CNCCC(=O)O)OC


Isomeric SMILES

CCCOC1=C(C=C(C=C1Br)CNCCC(=O)O)OC


InChI

InChI=1S/C14H20BrNO4/c1-3-6-20-14-11(15)7-10(8-12(14)19-2)9-16-5-4-13(17)18/h7-8,16H,3-6,9H2,1-2H3,(H,17,18)


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