diethyl (2S)-2-[[4-(4-oxidanylidenebutyl)phenyl]carbonylamino]pentanedioate

Systemtic Name: diethyl (2S)-2-[[4-(4-oxidanylidenebutyl)phenyl]carbonylamino]pentanedioate Openeye Name: diethyl (2S)-2-[[4-(4-oxobutyl)benzoyl]amino]pentanedioate CAS Name: (2S)-2-[[oxo-[4-(4-oxobutyl)phenyl]methyl]amino]pentanedioic acid diethyl ester IUPAC Name: diethyl (2S)-2-[[4-(4-oxobutyl)benzoyl]amino]pentanedioate Traditional Name: (2S)-2-[[4-(4-ketobutyl)benzoyl]amino]glutaric acid diethyl ester Formula: C20H27NO6 MolecularWeight: 377.43148

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(C(=O)OCC)NC(=O)C1=CC=C(C=C1)CCCC=O

Isomeric SMILES

CCOC(=O)CC[C@@H](C(=O)OCC)NC(=O)C1=CC=C(C=C1)CCCC=O

InChI

InChI=1S/C20H27NO6/c1-3-26-18(23)13-12-17(20(25)27-4-2)21-19(24)16-10-8-15(9-11-16)7-5-6-14-22/h8-11,14,17H,3-7,12-13H2,1-2H3,(H,21,24)/t17-/m0/s1