[1-(4-morpholin-4-ylcarbonylphenyl)piperidin-4-yl]-[[(3R)-1-pyrimidin-2-ylpiperidin-3-yl]methyl]azanium

Systemtic Name: [1-(4-morpholin-4-ylcarbonylphenyl)piperidin-4-yl]-[[(3R)-1-pyrimidin-2-ylpiperidin-3-yl]methyl]azanium Openeye Name: [1-[4-(morpholine-4-carbonyl)phenyl]-4-piperidyl]-[[(3R)-1-pyrimidin-2-yl-3-piperidyl]methyl]ammonium CAS Name: [1-[4-[4-morpholinyl(oxo)methyl]phenyl]-4-piperidinyl]-[[(3R)-1-(2-pyrimidinyl)-3-piperidinyl]methyl]ammonium IUPAC Name: [1-[4-(morpholine-4-carbonyl)phenyl]piperidin-4-yl]-[[(3R)-1-pyrimidin-2-ylpiperidin-3-yl]methyl]azanium Traditional Name: [1-[4-(morpholine-4-carbonyl)phenyl]-4-piperidyl]-[[(3R)-1-(2-pyrimidyl)-3-piperidyl]methyl]ammonium Formula: C26H37N6O2+ MolecularWeight: 465.61098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NC=CC=N2)C[NH2+]C3CCN(CC3)C4=CC=C(C=C4)C(=O)N5CCOCC5

Isomeric SMILES

C1C[C@@H](CN(C1)C2=NC=CC=N2)C[NH2+]C3CCN(CC3)C4=CC=C(C=C4)C(=O)N5CCOCC5

InChI

InChI=1S/C26H36N6O2/c33-25(31-15-17-34-18-16-31)22-4-6-24(7-5-22)30-13-8-23(9-14-30)29-19-21-3-1-12-32(20-21)26-27-10-2-11-28-26/h2,4-7,10-11,21,23,29H,1,3,8-9,12-20H2/p+1/t21-/m1/s1