methyl 4-[(1R,2S)-1-oxidanyl-3-phenyl-2-(phenylmethoxycarbonylamino)propyl]benzoate

Systemtic Name: methyl 4-[(1R,2S)-1-oxidanyl-3-phenyl-2-(phenylmethoxycarbonylamino)propyl]benzoate Openeye Name: methyl 4-[(1R,2S)-2-(benzyloxycarbonylamino)-1-hydroxy-3-phenyl-propyl]benzoate CAS Name: 4-[(1R,2S)-1-hydroxy-3-phenyl-2-(phenylmethoxycarbonylamino)propyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(1R,2S)-1-hydroxy-3-phenyl-2-(phenylmethoxycarbonylamino)propyl]benzoate Traditional Name: 4-[(1R,2S)-2-(benzyloxycarbonylamino)-1-hydroxy-3-phenyl-propyl]benzoic acid methyl ester Formula: C25H25NO5 MolecularWeight: 419.4697

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H25NO5/c1-30-24(28)21-14-12-20(13-15-21)23(27)22(16-18-8-4-2-5-9-18)26-25(29)31-17-19-10-6-3-7-11-19/h2-15,22-23,27H,16-17H2,1H3,(H,26,29)/t22-,23+/m0/s1