N-[(3-chloranyl-5-ethoxy-4-hexoxy-phenyl)methylideneamino]-4-nitro-benzamide

Systemtic Name: N-[(3-chloranyl-5-ethoxy-4-hexoxy-phenyl)methylideneamino]-4-nitro-benzamide Openeye Name: N-[(3-chloro-5-ethoxy-4-hexoxy-phenyl)methyleneamino]-4-nitro-benzamide CAS Name: N-[(3-chloro-5-ethoxy-4-hexoxyphenyl)methylideneamino]-4-nitrobenzamide IUPAC Name: N-[(3-chloro-5-ethoxy-4-hexoxyphenyl)methylideneamino]-4-nitrobenzamide Traditional Name: N-[(3-chloro-5-ethoxy-4-hexoxy-benzylidene)amino]-4-nitro-benzamide Formula: C22H26ClN3O5 MolecularWeight: 447.91194

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1Cl)C=NNC(=O)C2=CC=C(C=C2)[N+](=O)[O-])OCC

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1Cl)C=NNC(=O)C2=CC=C(C=C2)[N+](=O)[O-])OCC

InChI

InChI=1S/C22H26ClN3O5/c1-3-5-6-7-12-31-21-19(23)13-16(14-20(21)30-4-2)15-24-25-22(27)17-8-10-18(11-9-17)26(28)29/h8-11,13-15H,3-7,12H2,1-2H3,(H,25,27)