2-tert-butyl-1-(4-chlorophenyl)-3-methyl-5,6-dihydro-4H-pyrimidin-3-ium iodide

Systemtic Name: 2-tert-butyl-1-(4-chlorophenyl)-3-methyl-5,6-dihydro-4H-pyrimidin-3-ium iodide Openeye Name: 2-tert-butyl-1-(4-chlorophenyl)-3-methyl-5,6-dihydro-4H-pyrimidin-3-ium iodide CAS Name: 2-tert-butyl-1-(4-chlorophenyl)-3-methyl-5,6-dihydro-4H-pyrimidin-3-ium iodide IUPAC Name: 2-tert-butyl-1-(4-chlorophenyl)-3-methyl-5,6-dihydro-4H-pyrimidin-3-ium iodide Traditional Name: 2-tert-butyl-1-(4-chlorophenyl)-3-methyl-5,6-dihydro-4H-pyrimidin-3-ium iodide Formula: C15H22ClIN2 MolecularWeight: 392.70605

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=[N+](CCCN1C2=CC=C(C=C2)Cl)C.[I-]

Isomeric SMILES

CC(C)(C)C1=[N+](CCCN1C2=CC=C(C=C2)Cl)C.[I-]

InChI

InChI=1S/C15H22ClN2.HI/c1-15(2,3)14-17(4)10-5-11-18(14)13-8-6-12(16)7-9-13;/h6-9H,5,10-11H2,1-4H3;1H/q+1;/p-1