1-[(4-methylphenyl)methyl]-3-propyl-1,3-diazinan-3-ium

Systemtic Name: 1-[(4-methylphenyl)methyl]-3-propyl-1,3-diazinan-3-ium Openeye Name: 1-propyl-3-(p-tolylmethyl)hexahydropyrimidin-1-ium CAS Name: 1-[(4-methylphenyl)methyl]-3-propyl-1,3-diazinan-3-ium IUPAC Name: 1-[(4-methylphenyl)methyl]-3-propyl-1,3-diazinan-3-ium Traditional Name: 1-(4-methylbenzyl)-3-propyl-hexahydropyrimidin-3-ium Formula: C15H25N2+ MolecularWeight: 233.3724

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCCN(C1)CC2=CC=C(C=C2)C

Isomeric SMILES

CCC[NH+]1CCCN(C1)CC2=CC=C(C=C2)C

InChI

InChI=1S/C15H24N2/c1-3-9-16-10-4-11-17(13-16)12-15-7-5-14(2)6-8-15/h5-8H,3-4,9-13H2,1-2H3/p+1