N-(3,4-dimethyl-2,6-dinitro-phenyl)-N-pentan-3-yl-nitrous amide

Systemtic Name: N-(3,4-dimethyl-2,6-dinitro-phenyl)-N-pentan-3-yl-nitrous amide Openeye Name: N-(3,4-dimethyl-2,6-dinitro-phenyl)-N-(1-ethylpropyl)nitrous amide CAS Name: N-(3,4-dimethyl-2,6-dinitrophenyl)-N-pentan-3-ylnitrous amide IUPAC Name: N-(3,4-dimethyl-2,6-dinitrophenyl)-N-pentan-3-ylnitrous amide Traditional Name: N-(3,4-dimethyl-2,6-dinitro-phenyl)-N-(1-ethylpropyl)nitrous amide Formula: C13H18N4O5 MolecularWeight: 310.30582

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18N4O5/c1-5-10(6-2)15(14-18)13-11(16(19)20)7-8(3)9(4)12(13)17(21)22/h7,10H,5-6H2,1-4H3