N-(4-ethoxyphenyl)-3,5-dinitro-benzamide

Systemtic Name: N-(4-ethoxyphenyl)-3,5-dinitro-benzamide Openeye Name: N-(4-ethoxyphenyl)-3,5-dinitro-benzamide CAS Name: N-(4-ethoxyphenyl)-3,5-dinitrobenzamide IUPAC Name: N-(4-ethoxyphenyl)-3,5-dinitrobenzamide Traditional Name: 3,5-dinitro-N-p-phenetyl-benzamide Formula: C15H13N3O6 MolecularWeight: 331.28022

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H13N3O6/c1-2-24-14-5-3-11(4-6-14)16-15(19)10-7-12(17(20)21)9-13(8-10)18(22)23/h3-9H,2H2,1H3,(H,16,19)