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

Systemtic Name: 2-[[1,3-dimethyl-2,4,6-tris(oxidanylidene)-1,3-diazinan-5-ylidene]methyl]-4-methoxy-6-nitro-phenolate Openeye Name: 2-[(1,3-dimethyl-2,4,6-trioxo-hexahydropyrimidin-5-ylidene)methyl]-4-methoxy-6-nitro-phenolate CAS Name: 2-[(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]-4-methoxy-6-nitrophenolate IUPAC Name: 2-[(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]-4-methoxy-6-nitrophenolate Traditional Name: 4-methoxy-2-nitro-6-[(2,4,6-triketo-1,3-dimethyl-hexahydropyrimidin-5-ylidene)methyl]phenolate Formula: C14H12N3O7- MolecularWeight: 334.26098

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=CC2=CC(=CC(=C2[O-])[N+](=O)[O-])OC)C(=O)N(C1=O)C

Isomeric SMILES

CN1C(=O)C(=CC2=CC(=CC(=C2[O-])[N+](=O)[O-])OC)C(=O)N(C1=O)C

InChI

InChI=1S/C14H13N3O7/c1-15-12(19)9(13(20)16(2)14(15)21)5-7-4-8(24-3)6-10(11(7)18)17(22)23/h4-6,18H,1-3H3/p-1