6-ethoxy-N2-(4-iodophenyl)-N4-(2-morpholin-4-ium-4-ylethyl)-1,3,5-triazine-2,4-diamine

Systemtic Name: 6-ethoxy-N2-(4-iodophenyl)-N4-(2-morpholin-4-ium-4-ylethyl)-1,3,5-triazine-2,4-diamine Openeye Name: 6-ethoxy-N2-(4-iodophenyl)-N4-(2-morpholin-4-ium-4-ylethyl)-1,3,5-triazine-2,4-diamine CAS Name: 6-ethoxy-N2-(4-iodophenyl)-N4-[2-(4-morpholin-4-iumyl)ethyl]-1,3,5-triazine-2,4-diamine IUPAC Name: 6-ethoxy-2-N-(4-iodophenyl)-4-N-(2-morpholin-4-ium-4-ylethyl)-1,3,5-triazine-2,4-diamine Traditional Name: [4-ethoxy-6-(4-iodoanilino)-s-triazin-2-yl]-(2-morpholin-4-ium-4-ylethyl)amine Formula: C17H24IN6O2+ MolecularWeight: 471.31593

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC(=NC(=N1)NCC[NH+]2CCOCC2)NC3=CC=C(C=C3)I

Isomeric SMILES

CCOC1=NC(=NC(=N1)NCC[NH+]2CCOCC2)NC3=CC=C(C=C3)I

InChI

InChI=1S/C17H23IN6O2/c1-2-26-17-22-15(19-7-8-24-9-11-25-12-10-24)21-16(23-17)20-14-5-3-13(18)4-6-14/h3-6H,2,7-12H2,1H3,(H2,19,20,21,22,23)/p+1