ethyl 4-[(E)-[2-[(4-nitrophenyl)carbonylamino]phenyl]methylideneamino]oxybutanoate

Systemtic Name: ethyl 4-[(E)-[2-[(4-nitrophenyl)carbonylamino]phenyl]methylideneamino]oxybutanoate Openeye Name: ethyl 4-[(E)-[2-[(4-nitrobenzoyl)amino]phenyl]methyleneamino]oxybutanoate CAS Name: 4-[(E)-[2-[[(4-nitrophenyl)-oxomethyl]amino]phenyl]methylideneamino]oxybutanoic acid ethyl ester IUPAC Name: ethyl 4-[(E)-[2-[(4-nitrobenzoyl)amino]phenyl]methylideneamino]oxybutanoate Traditional Name: 4-[(E)-[2-[(4-nitrobenzoyl)amino]benzylidene]amino]oxybutyric acid ethyl ester Formula: C20H21N3O6 MolecularWeight: 399.39724

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCON=CC1=CC=CC=C1NC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CCCO/N=C/C1=CC=CC=C1NC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C20H21N3O6/c1-2-28-19(24)8-5-13-29-21-14-16-6-3-4-7-18(16)22-20(25)15-9-11-17(12-10-15)23(26)27/h3-4,6-7,9-12,14H,2,5,8,13H2,1H3,(H,22,25)/b21-14+