(3Z,8Z)-cyclodeca-3,8-diene-1,6-diamine; 2,4,6-trinitrophenol

Systemtic Name: (3Z,8Z)-cyclodeca-3,8-diene-1,6-diamine; 2,4,6-trinitrophenol Openeye Name: (3Z,8Z)-cyclodeca-3,8-diene-1,6-diamine; picric acid CAS Name: (3Z,8Z)-cyclodeca-3,8-diene-1,6-diamine; 2,4,6-trinitrophenol IUPAC Name: (3Z,8Z)-cyclodeca-3,8-diene-1,6-diamine; 2,4,6-trinitrophenol Traditional Name: [(3Z,8Z)-6-aminocyclodeca-3,8-dien-1-yl]amine; picric acid Formula: C22H24N8O14 MolecularWeight: 624.47116

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CCC(CC=CCC1N)N.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-].C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C/1C(C/C=C\CC(C/C=C1)N)N.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-].C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C10H18N2.2C6H3N3O7/c11-9-5-1-2-6-10(12)8-4-3-7-9;2*10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h1-4,9-10H,5-8,11-12H2;2*1-2,10H/b2-1-,4-3-;;