bis(azanyl)methylidene-(5-methoxycarbonylfuran-2-yl)carbonyl-azanium; 2,4,6-trinitrophenolate

Systemtic Name: bis(azanyl)methylidene-(5-methoxycarbonylfuran-2-yl)carbonyl-azanium; 2,4,6-trinitrophenolate Openeye Name: diaminomethylene-(5-methoxycarbonylfuran-2-carbonyl)ammonium; 2,4,6-trinitrophenolate CAS Name: diaminomethylidene-[(5-methoxycarbonyl-2-furanyl)-oxomethyl]ammonium; 2,4,6-trinitrophenolate IUPAC Name: diaminomethylidene-(5-methoxycarbonylfuran-2-carbonyl)azanium; 2,4,6-trinitrophenolate Traditional Name: (5-carbomethoxy-2-furoyl)-(diaminomethylene)ammonium picrate Formula: C14H12N6O11 MolecularWeight: 440.27868

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(O1)C(=O)[NH+]=C(N)N.C1=C(C=C(C(=C1[N+](=O)[O-])[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC=C(O1)C(=O)[NH+]=C(N)N.C1=C(C=C(C(=C1[N+](=O)[O-])[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C8H9N3O4.C6H3N3O7/c1-14-7(13)5-3-2-4(15-5)6(12)11-8(9)10;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h2-3H,1H3,(H4,9,10,11,12);1-2,10H