2-methoxypropyl [2-(1-methylquinolin-1-ium-2-yl)phenyl] hydrogen phosphate

Systemtic Name: 2-methoxypropyl [2-(1-methylquinolin-1-ium-2-yl)phenyl] hydrogen phosphate Openeye Name: 2-methoxypropyl [2-(1-methylquinolin-1-ium-2-yl)phenyl] hydrogen phosphate CAS Name: 2-methoxypropyl [2-(1-methyl-2-quinolin-1-iumyl)phenyl] hydrogen phosphate IUPAC Name: 2-methoxypropyl [2-(1-methylquinolin-1-ium-2-yl)phenyl] hydrogen phosphate Traditional Name: 2-methoxypropyl [2-(1-methylquinolin-1-ium-2-yl)phenyl] hydrogen phosphate Formula: C20H23NO5P+ MolecularWeight: 388.374081

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Descriptors Computed from Structure

Canonical SMILES:

CC(COP(=O)(O)OC1=CC=CC=C1C2=[N+](C3=CC=CC=C3C=C2)C)OC

Isomeric SMILES

CC(COP(=O)(O)OC1=CC=CC=C1C2=[N+](C3=CC=CC=C3C=C2)C)OC

InChI

InChI=1S/C20H22NO5P/c1-15(24-3)14-25-27(22,23)26-20-11-7-5-9-17(20)19-13-12-16-8-4-6-10-18(16)21(19)2/h4-13,15H,14H2,1-3H3/p+1