N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]pyrimidin-2-amine

Systemtic Name: N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]pyrimidin-2-amine Openeye Name: N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]pyrimidin-2-amine CAS Name: N-[[4-(1-piperidin-1-iumylmethyl)phenyl]methyl]-2-pyrimidinamine IUPAC Name: N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]pyrimidin-2-amine Traditional Name: [4-(piperidin-1-ium-1-ylmethyl)benzyl]-(2-pyrimidyl)amine Formula: C17H23N4+ MolecularWeight: 283.39132

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=CC=C(C=C2)CNC3=NC=CC=N3

Isomeric SMILES

C1CC[NH+](CC1)CC2=CC=C(C=C2)CNC3=NC=CC=N3

InChI

InChI=1S/C17H22N4/c1-2-11-21(12-3-1)14-16-7-5-15(6-8-16)13-20-17-18-9-4-10-19-17/h4-10H,1-3,11-14H2,(H,18,19,20)/p+1