diethyl 2-[[4-[(E)-4-nitrobut-3-enyl]phenyl]carbonylamino]pentanedioate

Systemtic Name: diethyl 2-[[4-[(E)-4-nitrobut-3-enyl]phenyl]carbonylamino]pentanedioate Openeye Name: diethyl 2-[[4-[(E)-4-nitrobut-3-enyl]benzoyl]amino]pentanedioate CAS Name: 2-[[[4-[(E)-4-nitrobut-3-enyl]phenyl]-oxomethyl]amino]pentanedioic acid diethyl ester IUPAC Name: diethyl 2-[[4-[(E)-4-nitrobut-3-enyl]benzoyl]amino]pentanedioate Traditional Name: 2-[[4-[(E)-4-nitrobut-3-enyl]benzoyl]amino]glutaric acid diethyl ester Formula: C20H26N2O7 MolecularWeight: 406.42964

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26N2O7/c1-3-28-18(23)13-12-17(20(25)29-4-2)21-19(24)16-10-8-15(9-11-16)7-5-6-14-22(26)27/h6,8-11,14,17H,3-5,7,12-13H2,1-2H3,(H,21,24)/b14-6+