N4,N4-dimethylcyclohexane-1,4-diamine; 2,4,6-trinitrophenol

Systemtic Name: N4,N4-dimethylcyclohexane-1,4-diamine; 2,4,6-trinitrophenol Openeye Name: N4,N4-dimethylcyclohexane-1,4-diamine; picric acid CAS Name: N4,N4-dimethylcyclohexane-1,4-diamine; 2,4,6-trinitrophenol IUPAC Name: 4-N,4-N-dimethylcyclohexane-1,4-diamine; 2,4,6-trinitrophenol Traditional Name: (4-aminocyclohexyl)-dimethyl-amine; picric acid Formula: C14H21N5O7 MolecularWeight: 371.34584

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1CCC(CC1)N.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CN(C)C1CCC(CC1)N.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C8H18N2.C6H3N3O7/c1-10(2)8-5-3-7(9)4-6-8;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h7-8H,3-6,9H2,1-2H3;1-2,10H