(phenylmethyl) 3-(4-bromophenyl)-2-[(phenylmethyl)amino]propanoate

Systemtic Name: (phenylmethyl) 3-(4-bromophenyl)-2-[(phenylmethyl)amino]propanoate Openeye Name: benzyl 2-(benzylamino)-3-(4-bromophenyl)propanoate CAS Name: 3-(4-bromophenyl)-2-[(phenylmethyl)amino]propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(benzylamino)-3-(4-bromophenyl)propanoate Traditional Name: 2-(benzylamino)-3-(4-bromophenyl)propionic acid benzyl ester Formula: C23H22BrNO2 MolecularWeight: 424.33028

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(CC2=CC=C(C=C2)Br)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CNC(CC2=CC=C(C=C2)Br)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C23H22BrNO2/c24-21-13-11-18(12-14-21)15-22(25-16-19-7-3-1-4-8-19)23(26)27-17-20-9-5-2-6-10-20/h1-14,22,25H,15-17H2