2-ethoxy-6-nitro-4-[[2,4,6-tris(oxidanylidene)-1,3-diazinan-5-ylidene]methyl]phenolate

Systemtic Name: 2-ethoxy-6-nitro-4-[[2,4,6-tris(oxidanylidene)-1,3-diazinan-5-ylidene]methyl]phenolate Openeye Name: 2-ethoxy-6-nitro-4-[(2,4,6-trioxohexahydropyrimidin-5-ylidene)methyl]phenolate CAS Name: 2-ethoxy-6-nitro-4-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]phenolate IUPAC Name: 2-ethoxy-6-nitro-4-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]phenolate Traditional Name: 2-ethoxy-6-nitro-4-[(2,4,6-triketohexahydropyrimidin-5-ylidene)methyl]phenolate Formula: C13H10N3O7- MolecularWeight: 320.2344

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1[O-])[N+](=O)[O-])C=C2C(=O)NC(=O)NC2=O

Isomeric SMILES

CCOC1=CC(=CC(=C1[O-])[N+](=O)[O-])C=C2C(=O)NC(=O)NC2=O

InChI

InChI=1S/C13H11N3O7/c1-2-23-9-5-6(4-8(10(9)17)16(21)22)3-7-11(18)14-13(20)15-12(7)19/h3-5,17H,2H2,1H3,(H2,14,15,18,19,20)/p-1