3-[(3-bromanyl-4-methoxy-phenyl)methyl-[(3-bromophenyl)methyl]amino]propanoic acid

Systemtic Name: 3-[(3-bromanyl-4-methoxy-phenyl)methyl-[(3-bromophenyl)methyl]amino]propanoic acid Openeye Name: 3-[(3-bromo-4-methoxy-phenyl)methyl-[(3-bromophenyl)methyl]amino]propanoic acid CAS Name: 3-[(3-bromo-4-methoxyphenyl)methyl-[(3-bromophenyl)methyl]amino]propanoic acid IUPAC Name: 3-[(3-bromo-4-methoxyphenyl)methyl-[(3-bromophenyl)methyl]amino]propanoic acid Traditional Name: 3-[(3-bromobenzyl)-(3-bromo-4-methoxy-benzyl)amino]propionic acid Formula: C18H19Br2NO3 MolecularWeight: 457.15636

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN(CCC(=O)O)CC2=CC(=CC=C2)Br)Br

Isomeric SMILES

COC1=C(C=C(C=C1)CN(CCC(=O)O)CC2=CC(=CC=C2)Br)Br

InChI

InChI=1S/C18H19Br2NO3/c1-24-17-6-5-14(10-16(17)20)12-21(8-7-18(22)23)11-13-3-2-4-15(19)9-13/h2-6,9-10H,7-8,11-12H2,1H3,(H,22,23)