4-[(3,4,5-trimethoxyphenyl)methyl]pyrimidin-1-ium-1,2-diamine

Systemtic Name: 4-[(3,4,5-trimethoxyphenyl)methyl]pyrimidin-1-ium-1,2-diamine Openeye Name: 4-[(3,4,5-trimethoxyphenyl)methyl]pyrimidin-1-ium-1,2-diamine CAS Name: 4-[(3,4,5-trimethoxyphenyl)methyl]pyrimidin-1-ium-1,2-diamine IUPAC Name: 4-[(3,4,5-trimethoxyphenyl)methyl]pyrimidin-1-ium-1,2-diamine Traditional Name: [1-amino-4-(3,4,5-trimethoxybenzyl)pyrimidin-1-ium-2-yl]amine Formula: C14H19N4O3+ MolecularWeight: 291.32566

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CC2=NC(=[N+](C=C2)N)N

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CC2=NC(=[N+](C=C2)N)N

InChI

InChI=1S/C14H18N4O3/c1-19-11-7-9(8-12(20-2)13(11)21-3)6-10-4-5-18(16)14(15)17-10/h4-5,7-8,15H,6,16H2,1-3H3/p+1