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

Systemtic Name: 2-[[1,3-dimethyl-2,4,6-tris(oxidanylidene)-1,3-diazinan-5-ylidene]methyl]-6-methoxy-4-nitro-phenolate Openeye Name: 2-[(1,3-dimethyl-2,4,6-trioxo-hexahydropyrimidin-5-ylidene)methyl]-6-methoxy-4-nitro-phenolate CAS Name: 2-[(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]-6-methoxy-4-nitrophenolate IUPAC Name: 2-[(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]-6-methoxy-4-nitrophenolate Traditional Name: 2-methoxy-4-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-])OC)[N+](=O)[O-])C(=O)N(C1=O)C

Isomeric SMILES

CN1C(=O)C(=CC2=CC(=CC(=C2[O-])OC)[N+](=O)[O-])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(17(22)23)6-10(24-3)11(7)18/h4-6,18H,1-3H3/p-1