(4-chlorophenyl)methyl-[(3S)-1-pyrimidin-2-ylpiperidin-3-yl]azanium

Systemtic Name: (4-chlorophenyl)methyl-[(3S)-1-pyrimidin-2-ylpiperidin-3-yl]azanium Openeye Name: (4-chlorophenyl)methyl-[(3S)-1-pyrimidin-2-yl-3-piperidyl]ammonium CAS Name: (4-chlorophenyl)methyl-[(3S)-1-(2-pyrimidinyl)-3-piperidinyl]ammonium IUPAC Name: (4-chlorophenyl)methyl-[(3S)-1-pyrimidin-2-ylpiperidin-3-yl]azanium Traditional Name: (4-chlorobenzyl)-[(3S)-1-(2-pyrimidyl)-3-piperidyl]ammonium Formula: C16H20ClN4+ MolecularWeight: 303.8098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NC=CC=N2)[NH2+]CC3=CC=C(C=C3)Cl

Isomeric SMILES

C1C[C@@H](CN(C1)C2=NC=CC=N2)[NH2+]CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H19ClN4/c17-14-6-4-13(5-7-14)11-20-15-3-1-10-21(12-15)16-18-8-2-9-19-16/h2,4-9,15,20H,1,3,10-12H2/p+1/t15-/m0/s1