3-[(4-bromophenyl)methyl-methyl-azaniumyl]propanoate

Systemtic Name: 3-[(4-bromophenyl)methyl-methyl-azaniumyl]propanoate Openeye Name: 3-[(4-bromophenyl)methyl-methyl-ammonio]propanoate CAS Name: 3-[(4-bromophenyl)methyl-methylammonio]propanoate IUPAC Name: 3-[(4-bromophenyl)methyl-methylazaniumyl]propanoate Traditional Name: 3-[(4-bromobenzyl)-methyl-ammonio]propionate Formula: C11H14BrNO2 MolecularWeight: 272.13836

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC(=O)[O-])CC1=CC=C(C=C1)Br

Isomeric SMILES

C[NH+](CCC(=O)[O-])CC1=CC=C(C=C1)Br

InChI

InChI=1S/C11H14BrNO2/c1-13(7-6-11(14)15)8-9-2-4-10(12)5-3-9/h2-5H,6-8H2,1H3,(H,14,15)