tert-butyl (2S)-2-[(2-chlorophenyl)methoxy]-4-oxidanylidene-3-(prop-2-enoxycarbonylamino)pentanoate

Systemtic Name: tert-butyl (2S)-2-[(2-chlorophenyl)methoxy]-4-oxidanylidene-3-(prop-2-enoxycarbonylamino)pentanoate Openeye Name: tert-butyl (2S)-3-(allyloxycarbonylamino)-2-[(2-chlorophenyl)methoxy]-4-oxo-pentanoate CAS Name: (2S)-2-[(2-chlorophenyl)methoxy]-4-oxo-3-[[oxo(prop-2-enoxy)methyl]amino]pentanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[(2-chlorophenyl)methoxy]-4-oxo-3-(prop-2-enoxycarbonylamino)pentanoate Traditional Name: (2S)-3-(allyloxycarbonylamino)-2-(2-chlorobenzyl)oxy-4-keto-valeric acid tert-butyl ester Formula: C20H26ClNO6 MolecularWeight: 411.87654

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C(C(=O)OC(C)(C)C)OCC1=CC=CC=C1Cl)NC(=O)OCC=C

Isomeric SMILES

CC(=O)C([C@@H](C(=O)OC(C)(C)C)OCC1=CC=CC=C1Cl)NC(=O)OCC=C

InChI

InChI=1S/C20H26ClNO6/c1-6-11-26-19(25)22-16(13(2)23)17(18(24)28-20(3,4)5)27-12-14-9-7-8-10-15(14)21/h6-10,16-17H,1,11-12H2,2-5H3,(H,22,25)/t16?,17-/m0/s1