N-[(5-bromanyl-2-hexoxy-phenyl)methylideneamino]-4-nitro-benzamide

Systemtic Name: N-[(5-bromanyl-2-hexoxy-phenyl)methylideneamino]-4-nitro-benzamide Openeye Name: N-[(5-bromo-2-hexoxy-phenyl)methyleneamino]-4-nitro-benzamide CAS Name: N-[(5-bromo-2-hexoxyphenyl)methylideneamino]-4-nitrobenzamide IUPAC Name: N-[(5-bromo-2-hexoxyphenyl)methylideneamino]-4-nitrobenzamide Traditional Name: N-[(5-bromo-2-hexoxy-benzylidene)amino]-4-nitro-benzamide Formula: C20H22BrN3O4 MolecularWeight: 448.31038

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)Br)C=NNC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)Br)C=NNC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C20H22BrN3O4/c1-2-3-4-5-12-28-19-11-8-17(21)13-16(19)14-22-23-20(25)15-6-9-18(10-7-15)24(26)27/h6-11,13-14H,2-5,12H2,1H3,(H,23,25)