tert-butyl (E)-5-[[(2S)-1-ethoxy-1-oxidanylidene-3-phenyl-propan-2-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]pent-2-enoate

Systemtic Name: tert-butyl (E)-5-[[(2S)-1-ethoxy-1-oxidanylidene-3-phenyl-propan-2-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]pent-2-enoate Openeye Name: tert-butyl (E)-5-[[(1S)-1-benzyl-2-ethoxy-2-oxo-ethyl]-tert-butoxycarbonyl-amino]pent-2-enoate CAS Name: (E)-5-[[(2S)-1-ethoxy-1-oxo-3-phenylpropan-2-yl]-[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-pentenoic acid tert-butyl ester IUPAC Name: tert-butyl (E)-5-[[(2S)-1-ethoxy-1-oxo-3-phenylpropan-2-yl]-[(2-methylpropan-2-yl)oxycarbonyl]amino]pent-2-enoate Traditional Name: (E)-5-[[(1S)-1-benzyl-2-ethoxy-2-keto-ethyl]-tert-butoxycarbonyl-amino]pent-2-enoic acid tert-butyl ester Formula: C25H37NO6 MolecularWeight: 447.56438

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=CC=C1)N(CCC=CC(=O)OC(C)(C)C)C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)[C@H](CC1=CC=CC=C1)N(CC/C=C/C(=O)OC(C)(C)C)C(=O)OC(C)(C)C

InChI

InChI=1S/C25H37NO6/c1-8-30-22(28)20(18-19-14-10-9-11-15-19)26(23(29)32-25(5,6)7)17-13-12-16-21(27)31-24(2,3)4/h9-12,14-16,20H,8,13,17-18H2,1-7H3/b16-12+/t20-/m0/s1