4-bromanyl-N-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]aniline

Systemtic Name: 4-bromanyl-N-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]aniline Openeye Name: N-[(4-benzyloxy-3-methoxy-phenyl)methyl]-4-bromo-aniline CAS Name: 4-bromo-N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]aniline IUPAC Name: 4-bromo-N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]aniline Traditional Name: (4-benzoxy-3-methoxy-benzyl)-(4-bromophenyl)amine Formula: C21H20BrNO2 MolecularWeight: 398.293

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CNC2=CC=C(C=C2)Br)OCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)CNC2=CC=C(C=C2)Br)OCC3=CC=CC=C3

InChI

InChI=1S/C21H20BrNO2/c1-24-21-13-17(14-23-19-10-8-18(22)9-11-19)7-12-20(21)25-15-16-5-3-2-4-6-16/h2-13,23H,14-15H2,1H3