[1-[4-(3-methoxyphenyl)phenyl]piperidin-4-yl]-(pyrimidin-4-ylmethyl)azanium

Systemtic Name: [1-[4-(3-methoxyphenyl)phenyl]piperidin-4-yl]-(pyrimidin-4-ylmethyl)azanium Openeye Name: [1-[4-(3-methoxyphenyl)phenyl]-4-piperidyl]-(pyrimidin-4-ylmethyl)ammonium CAS Name: [1-[4-(3-methoxyphenyl)phenyl]-4-piperidinyl]-(4-pyrimidinylmethyl)ammonium IUPAC Name: [1-[4-(3-methoxyphenyl)phenyl]piperidin-4-yl]-(pyrimidin-4-ylmethyl)azanium Traditional Name: [1-[4-(3-methoxyphenyl)phenyl]-4-piperidyl]-(4-pyrimidylmethyl)ammonium Formula: C23H27N4O+ MolecularWeight: 375.48668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=CC=C(C=C2)N3CCC(CC3)[NH2+]CC4=NC=NC=C4

Isomeric SMILES

COC1=CC=CC(=C1)C2=CC=C(C=C2)N3CCC(CC3)[NH2+]CC4=NC=NC=C4

InChI

InChI=1S/C23H26N4O/c1-28-23-4-2-3-19(15-23)18-5-7-22(8-6-18)27-13-10-20(11-14-27)25-16-21-9-12-24-17-26-21/h2-9,12,15,17,20,25H,10-11,13-14,16H2,1H3/p+1