3,5-dinitro-N-pentan-2-yl-benzamide

Systemtic Name: 3,5-dinitro-N-pentan-2-yl-benzamide Openeye Name: N-(1-methylbutyl)-3,5-dinitro-benzamide CAS Name: 3,5-dinitro-N-pentan-2-ylbenzamide IUPAC Name: 3,5-dinitro-N-pentan-2-ylbenzamide Traditional Name: N-(1-methylbutyl)-3,5-dinitro-benzamide Formula: C12H15N3O5 MolecularWeight: 281.2646

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15N3O5/c1-3-4-8(2)13-12(16)9-5-10(14(17)18)7-11(6-9)15(19)20/h5-8H,3-4H2,1-2H3,(H,13,16)