ethyl 2-[2-azanyl-3-[4-(ethylamino)-6-(propan-2-ylamino)-1,3,5-triazin-2-yl]-5-oxidanylidene-4H-imidazol-1-ium-1-yl]ethanoate

Systemtic Name: ethyl 2-[2-azanyl-3-[4-(ethylamino)-6-(propan-2-ylamino)-1,3,5-triazin-2-yl]-5-oxidanylidene-4H-imidazol-1-ium-1-yl]ethanoate Openeye Name: ethyl 2-[2-amino-3-[4-(ethylamino)-6-(isopropylamino)-1,3,5-triazin-2-yl]-5-oxo-4H-imidazol-1-ium-1-yl]acetate CAS Name: 2-[2-amino-3-[4-(ethylamino)-6-(propan-2-ylamino)-1,3,5-triazin-2-yl]-5-oxo-4H-imidazol-1-ium-1-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-amino-3-[4-(ethylamino)-6-(propan-2-ylamino)-1,3,5-triazin-2-yl]-5-oxo-4H-imidazol-1-ium-1-yl]acetate Traditional Name: 2-[2-amino-3-[4-(ethylamino)-6-(isopropylamino)-s-triazin-2-yl]-5-keto-2-imidazolin-1-ium-1-yl]acetic acid ethyl ester Formula: C15H25N8O3+ MolecularWeight: 365.4108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC(=NC(=N1)N2CC(=O)[N+](=C2N)CC(=O)OCC)NC(C)C

Isomeric SMILES

CCNC1=NC(=NC(=N1)N2CC(=O)[N+](=C2N)CC(=O)OCC)NC(C)C

InChI

InChI=1S/C15H24N8O3/c1-5-17-13-19-14(18-9(3)4)21-15(20-13)23-7-10(24)22(12(23)16)8-11(25)26-6-2/h9,16H,5-8H2,1-4H3,(H2,17,18,19,20,21)/p+1