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

Systemtic Name: 4-[[1,3-dimethyl-4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]-2-methoxy-6-nitro-phenolate Openeye Name: 4-[(1,3-dimethyl-4,6-dioxo-2-thioxo-hexahydropyrimidin-5-ylidene)methyl]-2-methoxy-6-nitro-phenolate CAS Name: 4-[(1,3-dimethyl-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methyl]-2-methoxy-6-nitrophenolate IUPAC Name: 4-[(1,3-dimethyl-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methyl]-2-methoxy-6-nitrophenolate Traditional Name: 4-[(4,6-diketo-1,3-dimethyl-2-thioxo-hexahydropyrimidin-5-ylidene)methyl]-2-methoxy-6-nitro-phenolate Formula: C14H12N3O6S- MolecularWeight: 350.32658

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13N3O6S/c1-15-12(19)8(13(20)16(2)14(15)24)4-7-5-9(17(21)22)11(18)10(6-7)23-3/h4-6,18H,1-3H3/p-1