4-azanyl-4-(3-bromanyl-4-methoxy-phenyl)butanoic acid

Systemtic Name: 4-azanyl-4-(3-bromanyl-4-methoxy-phenyl)butanoic acid Openeye Name: 4-amino-4-(3-bromo-4-methoxy-phenyl)butanoic acid CAS Name: 4-amino-4-(3-bromo-4-methoxyphenyl)butanoic acid IUPAC Name: 4-amino-4-(3-bromo-4-methoxyphenyl)butanoic acid Traditional Name: 4-amino-4-(3-bromo-4-methoxy-phenyl)butyric acid Formula: C11H14BrNO3 MolecularWeight: 288.13776

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CCC(=O)O)N)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C(CCC(=O)O)N)Br

InChI

InChI=1S/C11H14BrNO3/c1-16-10-4-2-7(6-8(10)12)9(13)3-5-11(14)15/h2,4,6,9H,3,5,13H2,1H3,(H,14,15)