ethyl (2S,3S)-3-oxidanyl-3-phenyl-2-[[(2S)-1-[(E)-3-phenylprop-2-enoyl]pyrrolidin-2-yl]carbonylamino]propanoate

Systemtic Name: ethyl (2S,3S)-3-oxidanyl-3-phenyl-2-[[(2S)-1-[(E)-3-phenylprop-2-enoyl]pyrrolidin-2-yl]carbonylamino]propanoate Openeye Name: ethyl (2S,3S)-3-hydroxy-3-phenyl-2-[[(2S)-1-[(E)-3-phenylprop-2-enoyl]pyrrolidine-2-carbonyl]amino]propanoate CAS Name: (2S,3S)-3-hydroxy-2-[[oxo-[(2S)-1-[(E)-1-oxo-3-phenylprop-2-enyl]-2-pyrrolidinyl]methyl]amino]-3-phenylpropanoic acid ethyl ester IUPAC Name: ethyl (2S,3S)-3-hydroxy-3-phenyl-2-[[(2S)-1-[(E)-3-phenylprop-2-enoyl]pyrrolidine-2-carbonyl]amino]propanoate Traditional Name: (2S,3S)-3-hydroxy-3-phenyl-2-[[(2S)-1-[(E)-3-phenylacryloyl]prolyl]amino]propionic acid ethyl ester Formula: C25H28N2O5 MolecularWeight: 436.50022

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C1=CC=CC=C1)O)NC(=O)C2CCCN2C(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)[C@H]([C@H](C1=CC=CC=C1)O)NC(=O)[C@@H]2CCCN2C(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C25H28N2O5/c1-2-32-25(31)22(23(29)19-12-7-4-8-13-19)26-24(30)20-14-9-17-27(20)21(28)16-15-18-10-5-3-6-11-18/h3-8,10-13,15-16,20,22-23,29H,2,9,14,17H2,1H3,(H,26,30)/b16-15+/t20-,22-,23-/m0/s1