methyl (2S)-2-[(5-bromanyl-2-phenyl-1,3-oxazol-4-yl)methyl-phenylmethoxycarbonyl-amino]propanoate

Systemtic Name: methyl (2S)-2-[(5-bromanyl-2-phenyl-1,3-oxazol-4-yl)methyl-phenylmethoxycarbonyl-amino]propanoate Openeye Name: methyl (2S)-2-[benzyloxycarbonyl-[(5-bromo-2-phenyl-oxazol-4-yl)methyl]amino]propanoate CAS Name: (2S)-2-[(5-bromo-2-phenyl-4-oxazolyl)methyl-phenylmethoxycarbonylamino]propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(5-bromo-2-phenyl-1,3-oxazol-4-yl)methyl-phenylmethoxycarbonylamino]propanoate Traditional Name: (2S)-2-[(5-bromo-2-phenyl-oxazol-4-yl)methyl-carbobenzoxy-amino]propionic acid methyl ester Formula: C22H21BrN2O5 MolecularWeight: 473.31654

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)N(CC1=C(OC(=N1)C2=CC=CC=C2)Br)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

C[C@@H](C(=O)OC)N(CC1=C(OC(=N1)C2=CC=CC=C2)Br)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H21BrN2O5/c1-15(21(26)28-2)25(22(27)29-14-16-9-5-3-6-10-16)13-18-19(23)30-20(24-18)17-11-7-4-8-12-17/h3-12,15H,13-14H2,1-2H3/t15-/m0/s1