(6-chloranylpyridin-3-yl)methyl (2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: (6-chloranylpyridin-3-yl)methyl (2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoate Openeye Name: (6-chloro-3-pyridyl)methyl (2S)-2-(benzyloxycarbonylamino)-3-phenyl-propanoate CAS Name: (2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoic acid (6-chloro-3-pyridinyl)methyl ester IUPAC Name: (6-chloropyridin-3-yl)methyl (2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoate Traditional Name: (2S)-2-(benzyloxycarbonylamino)-3-phenyl-propionic acid (6-chloro-3-pyridyl)methyl ester Formula: C23H21ClN2O4 MolecularWeight: 424.87684

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)OCC2=CN=C(C=C2)Cl)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)OCC2=CN=C(C=C2)Cl)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C23H21ClN2O4/c24-21-12-11-19(14-25-21)16-29-22(27)20(13-17-7-3-1-4-8-17)26-23(28)30-15-18-9-5-2-6-10-18/h1-12,14,20H,13,15-16H2,(H,26,28)/t20-/m0/s1