2-[2-azanyl-3-[4-(dimethylamino)-6-methoxy-1,3,5-triazin-2-yl]-5-oxidanylidene-4H-imidazol-1-ium-1-yl]ethanoate

Systemtic Name: 2-[2-azanyl-3-[4-(dimethylamino)-6-methoxy-1,3,5-triazin-2-yl]-5-oxidanylidene-4H-imidazol-1-ium-1-yl]ethanoate Openeye Name: 2-[2-amino-3-[4-(dimethylamino)-6-methoxy-1,3,5-triazin-2-yl]-5-oxo-4H-imidazol-1-ium-1-yl]acetate CAS Name: 2-[2-amino-3-[4-(dimethylamino)-6-methoxy-1,3,5-triazin-2-yl]-5-oxo-4H-imidazol-1-ium-1-yl]acetate IUPAC Name: 2-[2-amino-3-[4-(dimethylamino)-6-methoxy-1,3,5-triazin-2-yl]-5-oxo-4H-imidazol-1-ium-1-yl]acetate Traditional Name: 2-[2-amino-3-[4-(dimethylamino)-6-methoxy-s-triazin-2-yl]-5-keto-2-imidazolin-1-ium-1-yl]acetate Formula: C11H15N7O4 MolecularWeight: 309.2813

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC(=NC(=N1)N2CC(=O)[N+](=C2N)CC(=O)[O-])OC

Isomeric SMILES

CN(C)C1=NC(=NC(=N1)N2CC(=O)[N+](=C2N)CC(=O)[O-])OC

InChI

InChI=1S/C11H15N7O4/c1-16(2)9-13-10(15-11(14-9)22-3)18-4-6(19)17(8(18)12)5-7(20)21/h12H,4-5H2,1-3H3,(H,20,21)