4-tert-butyl-6-deuterio-1-(phenylmethyl)pyrimidin-1-ium

Systemtic Name: 4-tert-butyl-6-deuterio-1-(phenylmethyl)pyrimidin-1-ium Openeye Name: 1-benzyl-4-tert-butyl-6-deuterio-pyrimidin-1-ium CAS Name: 4-tert-butyl-6-deuterio-1-(phenylmethyl)pyrimidin-1-ium IUPAC Name: 1-benzyl-4-tert-butyl-6-deuteriopyrimidin-1-ium Traditional Name: 1-benzyl-4-tert-butyl-6-deuterio-pyrimidin-1-ium Formula: C15H19N2+ MolecularWeight: 228.330922

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC=[N+](C=C1)CC2=CC=CC=C2

Isomeric SMILES

[2H]C1=CC(=NC=[N+]1CC2=CC=CC=C2)C(C)(C)C

InChI

InChI=1S/C15H19N2/c1-15(2,3)14-9-10-17(12-16-14)11-13-7-5-4-6-8-13/h4-10,12H,11H2,1-3H3/q+1/i10D