2-(4-butoxyphenoxy)-N-[(E)-(5-chloranyl-2-nitro-phenyl)methylideneamino]ethanamide

Systemtic Name: 2-(4-butoxyphenoxy)-N-[(E)-(5-chloranyl-2-nitro-phenyl)methylideneamino]ethanamide Openeye Name: 2-(4-butoxyphenoxy)-N-[(E)-(5-chloro-2-nitro-phenyl)methyleneamino]acetamide CAS Name: 2-(4-butoxyphenoxy)-N-[(E)-(5-chloro-2-nitrophenyl)methylideneamino]acetamide IUPAC Name: 2-(4-butoxyphenoxy)-N-[(E)-(5-chloro-2-nitrophenyl)methylideneamino]acetamide Traditional Name: 2-(4-butoxyphenoxy)-N-[(E)-(5-chloro-2-nitro-benzylidene)amino]acetamide Formula: C19H20ClN3O5 MolecularWeight: 405.8322

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)OCC(=O)NN=CC2=C(C=CC(=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CCCCOC1=CC=C(C=C1)OCC(=O)N/N=C/C2=C(C=CC(=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H20ClN3O5/c1-2-3-10-27-16-5-7-17(8-6-16)28-13-19(24)22-21-12-14-11-15(20)4-9-18(14)23(25)26/h4-9,11-12H,2-3,10,13H2,1H3,(H,22,24)/b21-12+