4-methyl-3,5-dinitro-N-pentyl-benzamide

Systemtic Name: 4-methyl-3,5-dinitro-N-pentyl-benzamide Openeye Name: 4-methyl-3,5-dinitro-N-pentyl-benzamide CAS Name: 4-methyl-3,5-dinitro-N-pentylbenzamide IUPAC Name: 4-methyl-3,5-dinitro-N-pentylbenzamide Traditional Name: N-amyl-4-methyl-3,5-dinitro-benzamide Formula: C13H17N3O5 MolecularWeight: 295.29118

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C1=CC(=C(C(=C1)[N+](=O)[O-])C)[N+](=O)[O-]

Isomeric SMILES

CCCCCNC(=O)C1=CC(=C(C(=C1)[N+](=O)[O-])C)[N+](=O)[O-]

InChI

InChI=1S/C13H17N3O5/c1-3-4-5-6-14-13(17)10-7-11(15(18)19)9(2)12(8-10)16(20)21/h7-8H,3-6H2,1-2H3,(H,14,17)