N-[4-(butanoylamino)phenyl]-3,5-dinitro-benzamide

Systemtic Name: N-[4-(butanoylamino)phenyl]-3,5-dinitro-benzamide Openeye Name: N-[4-(butanoylamino)phenyl]-3,5-dinitro-benzamide CAS Name: 3,5-dinitro-N-[4-(1-oxobutylamino)phenyl]benzamide IUPAC Name: N-[4-(butanoylamino)phenyl]-3,5-dinitrobenzamide Traditional Name: N-(4-butyramidophenyl)-3,5-dinitro-benzamide Formula: C17H16N4O6 MolecularWeight: 372.33214

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=C(C=C1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCCC(=O)NC1=CC=C(C=C1)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H16N4O6/c1-2-3-16(22)18-12-4-6-13(7-5-12)19-17(23)11-8-14(20(24)25)10-15(9-11)21(26)27/h4-10H,2-3H2,1H3,(H,18,22)(H,19,23)