ethyl (2S)-2-oxidanyl-3-[(E)-C-phenyl-N-phenylmethoxycarbonyl-carbonimidoyl]pentanoate

Systemtic Name: ethyl (2S)-2-oxidanyl-3-[(E)-C-phenyl-N-phenylmethoxycarbonyl-carbonimidoyl]pentanoate Openeye Name: ethyl (2S)-3-[(E)-N-benzyloxycarbonyl-C-phenyl-carbonimidoyl]-2-hydroxy-pentanoate CAS Name: (2S)-2-hydroxy-3-[(E)-phenyl(phenylmethoxycarbonylimino)methyl]pentanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-hydroxy-3-[(E)-C-phenyl-N-phenylmethoxycarbonylcarbonimidoyl]pentanoate Traditional Name: (2S)-3-[(E)-N-carbobenzoxy-C-phenyl-carbonimidoyl]-2-hydroxy-valeric acid ethyl ester Formula: C22H25NO5 MolecularWeight: 383.4376

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C(=O)OCC)O)C(=NC(=O)OCC1=CC=CC=C1)C2=CC=CC=C2

Isomeric SMILES

CCC([C@@H](C(=O)OCC)O)/C(=N\C(=O)OCC1=CC=CC=C1)/C2=CC=CC=C2

InChI

InChI=1S/C22H25NO5/c1-3-18(20(24)21(25)27-4-2)19(17-13-9-6-10-14-17)23-22(26)28-15-16-11-7-5-8-12-16/h5-14,18,20,24H,3-4,15H2,1-2H3/b23-19-/t18?,20-/m0/s1