trimethyl-[4-oxidanyl-4-oxidanylidene-2-[(4-phenethyloxypyrimidin-2-yl)amino]butyl]azanium

Systemtic Name: trimethyl-[4-oxidanyl-4-oxidanylidene-2-[(4-phenethyloxypyrimidin-2-yl)amino]butyl]azanium Openeye Name: [4-hydroxy-4-oxo-2-[(4-phenethyloxypyrimidin-2-yl)amino]butyl]-trimethyl-ammonium CAS Name: [4-hydroxy-4-oxo-2-[(4-phenethyloxy-2-pyrimidinyl)amino]butyl]-trimethylammonium IUPAC Name: [4-hydroxy-4-oxo-2-[(4-phenethyloxypyrimidin-2-yl)amino]butyl]-trimethylazanium Traditional Name: [4-hydroxy-4-keto-2-[(4-phenethyloxypyrimidin-2-yl)amino]butyl]-trimethyl-ammonium Formula: C19H27N4O3+ MolecularWeight: 359.44268

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CC(CC(=O)O)NC1=NC=CC(=N1)OCCC2=CC=CC=C2

Isomeric SMILES

C[N+](C)(C)CC(CC(=O)O)NC1=NC=CC(=N1)OCCC2=CC=CC=C2

InChI

InChI=1S/C19H26N4O3/c1-23(2,3)14-16(13-18(24)25)21-19-20-11-9-17(22-19)26-12-10-15-7-5-4-6-8-15/h4-9,11,16H,10,12-14H2,1-3H3,(H-,20,21,22,24,25)/p+1