1-methyl-3-[4-[4-(3-pyrazol-1-ylazetidin-1-ium-1-yl)piperidin-1-yl]phenyl]imidazolidin-2-one

Systemtic Name: 1-methyl-3-[4-[4-(3-pyrazol-1-ylazetidin-1-ium-1-yl)piperidin-1-yl]phenyl]imidazolidin-2-one Openeye Name: 1-methyl-3-[4-[4-(3-pyrazol-1-ylazetidin-1-ium-1-yl)-1-piperidyl]phenyl]imidazolidin-2-one CAS Name: 1-methyl-3-[4-[4-[3-(1-pyrazolyl)-1-azetidin-1-iumyl]-1-piperidinyl]phenyl]-2-imidazolidinone IUPAC Name: 1-methyl-3-[4-[4-(3-pyrazol-1-ylazetidin-1-ium-1-yl)piperidin-1-yl]phenyl]imidazolidin-2-one Traditional Name: 1-methyl-3-[4-[4-(3-pyrazol-1-ylazetidin-1-ium-1-yl)piperidino]phenyl]-2-imidazolidinone Formula: C21H29N6O+ MolecularWeight: 381.49456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(C1=O)C2=CC=C(C=C2)N3CCC(CC3)[NH+]4CC(C4)N5C=CC=N5

Isomeric SMILES

CN1CCN(C1=O)C2=CC=C(C=C2)N3CCC(CC3)[NH+]4CC(C4)N5C=CC=N5

InChI

InChI=1S/C21H28N6O/c1-23-13-14-26(21(23)28)19-5-3-17(4-6-19)24-11-7-18(8-12-24)25-15-20(16-25)27-10-2-9-22-27/h2-6,9-10,18,20H,7-8,11-16H2,1H3/p+1