3-morpholin-4-ium-4-ylpropyl-[(3-pyrimidin-2-yloxyphenyl)methyl]azanium

Systemtic Name: 3-morpholin-4-ium-4-ylpropyl-[(3-pyrimidin-2-yloxyphenyl)methyl]azanium Openeye Name: 3-morpholin-4-ium-4-ylpropyl-[(3-pyrimidin-2-yloxyphenyl)methyl]ammonium CAS Name: 3-(4-morpholin-4-iumyl)propyl-[[3-(2-pyrimidinyloxy)phenyl]methyl]ammonium IUPAC Name: 3-morpholin-4-ium-4-ylpropyl-[(3-pyrimidin-2-yloxyphenyl)methyl]azanium Traditional Name: 3-morpholin-4-ium-4-ylpropyl-[3-(2-pyrimidyloxy)benzyl]ammonium Formula: C18H26N4O2+2 MolecularWeight: 330.42464

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCC[NH2+]CC2=CC(=CC=C2)OC3=NC=CC=N3

Isomeric SMILES

C1COCC[NH+]1CCC[NH2+]CC2=CC(=CC=C2)OC3=NC=CC=N3

InChI

InChI=1S/C18H24N4O2/c1-4-16(14-17(5-1)24-18-20-7-2-8-21-18)15-19-6-3-9-22-10-12-23-13-11-22/h1-2,4-5,7-8,14,19H,3,6,9-13,15H2/p+2