(2S)-2-[ethoxycarbonyl-[(2S)-1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl]amino]propanoic acid

Systemtic Name: (2S)-2-[ethoxycarbonyl-[(2S)-1-ethoxy-1-oxidanylidene-4-phenyl-butan-2-yl]amino]propanoic acid Openeye Name: (2S)-2-[ethoxycarbonyl-[(1S)-1-ethoxycarbonyl-3-phenyl-propyl]amino]propanoic acid CAS Name: (2S)-2-[ethoxycarbonyl-[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino]propanoic acid IUPAC Name: (2S)-2-[ethoxycarbonyl-[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino]propanoic acid Traditional Name: (2S)-2-[carbethoxy-[(1S)-1-carbethoxy-3-phenyl-propyl]amino]propionic acid Formula: C18H25NO6 MolecularWeight: 351.3942

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC1=CC=CC=C1)N(C(C)C(=O)O)C(=O)OCC

Isomeric SMILES

CCOC(=O)[C@H](CCC1=CC=CC=C1)N([C@@H](C)C(=O)O)C(=O)OCC

InChI

InChI=1S/C18H25NO6/c1-4-24-17(22)15(12-11-14-9-7-6-8-10-14)19(13(3)16(20)21)18(23)25-5-2/h6-10,13,15H,4-5,11-12H2,1-3H3,(H,20,21)/t13-,15-/m0/s1