(phenylmethyl) (2S)-3-[4-(bromomethyl)phenyl]-2-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: (phenylmethyl) (2S)-3-[4-(bromomethyl)phenyl]-2-(phenylmethoxycarbonylamino)propanoate Openeye Name: benzyl (2S)-2-(benzyloxycarbonylamino)-3-[4-(bromomethyl)phenyl]propanoate CAS Name: (2S)-3-[4-(bromomethyl)phenyl]-2-(phenylmethoxycarbonylamino)propanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-3-[4-(bromomethyl)phenyl]-2-(phenylmethoxycarbonylamino)propanoate Traditional Name: (2S)-2-(benzyloxycarbonylamino)-3-[4-(bromomethyl)phenyl]propionic acid benzyl ester Formula: C25H24BrNO4 MolecularWeight: 482.36636

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C(CC2=CC=C(C=C2)CBr)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)[C@H](CC2=CC=C(C=C2)CBr)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C25H24BrNO4/c26-16-20-13-11-19(12-14-20)15-23(24(28)30-17-21-7-3-1-4-8-21)27-25(29)31-18-22-9-5-2-6-10-22/h1-14,23H,15-18H2,(H,27,29)/t23-/m0/s1