N2-(4-methoxyphenyl)-6-(morpholin-4-ium-4-ylmethyl)-1,3,5-triazine-2,4-diamine

Systemtic Name: N2-(4-methoxyphenyl)-6-(morpholin-4-ium-4-ylmethyl)-1,3,5-triazine-2,4-diamine Openeye Name: N2-(4-methoxyphenyl)-6-(morpholin-4-ium-4-ylmethyl)-1,3,5-triazine-2,4-diamine CAS Name: N2-(4-methoxyphenyl)-6-(4-morpholin-4-iumylmethyl)-1,3,5-triazine-2,4-diamine IUPAC Name: 2-N-(4-methoxyphenyl)-6-(morpholin-4-ium-4-ylmethyl)-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-(morpholin-4-ium-4-ylmethyl)-s-triazin-2-yl]-(4-methoxyphenyl)amine Formula: C15H21N6O2+ MolecularWeight: 317.36624

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2=NC(=NC(=N2)N)C[NH+]3CCOCC3

Isomeric SMILES

COC1=CC=C(C=C1)NC2=NC(=NC(=N2)N)C[NH+]3CCOCC3

InChI

InChI=1S/C15H20N6O2/c1-22-12-4-2-11(3-5-12)17-15-19-13(18-14(16)20-15)10-21-6-8-23-9-7-21/h2-5H,6-10H2,1H3,(H3,16,17,18,19,20)/p+1