diethyl (2S)-2-[(4-nitronaphthalen-1-yl)carbonylamino]pentanedioate

Systemtic Name: diethyl (2S)-2-[(4-nitronaphthalen-1-yl)carbonylamino]pentanedioate Openeye Name: diethyl (2S)-2-[(4-nitronaphthalene-1-carbonyl)amino]pentanedioate CAS Name: (2S)-2-[[(4-nitro-1-naphthalenyl)-oxomethyl]amino]pentanedioic acid diethyl ester IUPAC Name: diethyl (2S)-2-[(4-nitronaphthalene-1-carbonyl)amino]pentanedioate Traditional Name: (2S)-2-[(4-nitro-1-naphthoyl)amino]glutaric acid diethyl ester Formula: C20H22N2O7 MolecularWeight: 402.39788

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(C(=O)OCC)NC(=O)C1=CC=C(C2=CC=CC=C21)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CC[C@@H](C(=O)OCC)NC(=O)C1=CC=C(C2=CC=CC=C21)[N+](=O)[O-]

InChI

InChI=1S/C20H22N2O7/c1-3-28-18(23)12-10-16(20(25)29-4-2)21-19(24)15-9-11-17(22(26)27)14-8-6-5-7-13(14)15/h5-9,11,16H,3-4,10,12H2,1-2H3,(H,21,24)/t16-/m0/s1