3-[4,6-dimethyl-2-(phenylmethyl)pyrimidin-5-yl]propylazanium

Systemtic Name: 3-[4,6-dimethyl-2-(phenylmethyl)pyrimidin-5-yl]propylazanium Openeye Name: 3-(2-benzyl-4,6-dimethyl-pyrimidin-5-yl)propylammonium CAS Name: 3-[4,6-dimethyl-2-(phenylmethyl)-5-pyrimidinyl]propylammonium IUPAC Name: 3-(2-benzyl-4,6-dimethylpyrimidin-5-yl)propylazanium Traditional Name: 3-(2-benzyl-4,6-dimethyl-pyrimidin-5-yl)propylammonium Formula: C16H22N3+ MolecularWeight: 256.36598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)CC2=CC=CC=C2)C)CCC[NH3+]

Isomeric SMILES

CC1=C(C(=NC(=N1)CC2=CC=CC=C2)C)CCC[NH3+]

InChI

InChI=1S/C16H21N3/c1-12-15(9-6-10-17)13(2)19-16(18-12)11-14-7-4-3-5-8-14/h3-5,7-8H,6,9-11,17H2,1-2H3/p+1