5-phenylmethoxy-2-piperazin-4-ium-1-yl-pyrimidine

Systemtic Name: 5-phenylmethoxy-2-piperazin-4-ium-1-yl-pyrimidine Openeye Name: 5-benzyloxy-2-piperazin-4-ium-1-yl-pyrimidine CAS Name: 5-phenylmethoxy-2-(1-piperazin-4-iumyl)pyrimidine IUPAC Name: 5-phenylmethoxy-2-piperazin-4-ium-1-ylpyrimidine Traditional Name: 5-benzoxy-2-piperazin-4-ium-1-yl-pyrimidine Formula: C15H19N4O+ MolecularWeight: 271.33756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C2=NC=C(C=N2)OCC3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH2+]1)C2=NC=C(C=N2)OCC3=CC=CC=C3

InChI

InChI=1S/C15H18N4O/c1-2-4-13(5-3-1)12-20-14-10-17-15(18-11-14)19-8-6-16-7-9-19/h1-5,10-11,16H,6-9,12H2/p+1