2-methyl-4-(4-methylphenoxy)-6-piperazin-4-ium-1-yl-pyrimidine

Systemtic Name: 2-methyl-4-(4-methylphenoxy)-6-piperazin-4-ium-1-yl-pyrimidine Openeye Name: 2-methyl-4-(4-methylphenoxy)-6-piperazin-4-ium-1-yl-pyrimidine CAS Name: 2-methyl-4-(4-methylphenoxy)-6-(1-piperazin-4-iumyl)pyrimidine IUPAC Name: 2-methyl-4-(4-methylphenoxy)-6-piperazin-4-ium-1-ylpyrimidine Traditional Name: 2-methyl-4-(4-methylphenoxy)-6-piperazin-4-ium-1-yl-pyrimidine Formula: C16H21N4O+ MolecularWeight: 285.36414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC2=NC(=NC(=C2)N3CC[NH2+]CC3)C

Isomeric SMILES

CC1=CC=C(C=C1)OC2=NC(=NC(=C2)N3CC[NH2+]CC3)C

InChI

InChI=1S/C16H20N4O/c1-12-3-5-14(6-4-12)21-16-11-15(18-13(2)19-16)20-9-7-17-8-10-20/h3-6,11,17H,7-10H2,1-2H3/p+1