ethyl (2S)-5-(4-acetamidophenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxidanylidene-pentanoate

Systemtic Name: ethyl (2S)-5-(4-acetamidophenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxidanylidene-pentanoate Openeye Name: ethyl (2S)-5-(4-acetamidophenyl)-2-(tert-butoxycarbonylamino)-5-oxo-pentanoate CAS Name: (2S)-5-(4-acetamidophenyl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-5-oxopentanoic acid ethyl ester IUPAC Name: ethyl (2S)-5-(4-acetamidophenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxopentanoate Traditional Name: (2S)-5-(4-acetamidophenyl)-2-(tert-butoxycarbonylamino)-5-keto-valeric acid ethyl ester Formula: C20H28N2O6 MolecularWeight: 392.44612

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC(=O)C1=CC=C(C=C1)NC(=O)C)NC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)[C@H](CCC(=O)C1=CC=C(C=C1)NC(=O)C)NC(=O)OC(C)(C)C

InChI

InChI=1S/C20H28N2O6/c1-6-27-18(25)16(22-19(26)28-20(3,4)5)11-12-17(24)14-7-9-15(10-8-14)21-13(2)23/h7-10,16H,6,11-12H2,1-5H3,(H,21,23)(H,22,26)/t16-/m0/s1