(3-dodecoxy-5-methyl-phenyl) [2-(1-methylquinolin-1-ium-2-yl)phenyl] hydrogen phosphate

Systemtic Name: (3-dodecoxy-5-methyl-phenyl) [2-(1-methylquinolin-1-ium-2-yl)phenyl] hydrogen phosphate Openeye Name: (3-dodecoxy-5-methyl-phenyl) [2-(1-methylquinolin-1-ium-2-yl)phenyl] hydrogen phosphate CAS Name: (3-dodecoxy-5-methylphenyl) [2-(1-methyl-2-quinolin-1-iumyl)phenyl] hydrogen phosphate IUPAC Name: (3-dodecoxy-5-methylphenyl) [2-(1-methylquinolin-1-ium-2-yl)phenyl] hydrogen phosphate Traditional Name: (3-lauryloxy-5-methyl-phenyl) [2-(1-methylquinolin-1-ium-2-yl)phenyl] hydrogen phosphate Formula: C35H45NO5P+ MolecularWeight: 590.709261

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC(=CC(=C1)C)OP(=O)(O)OC2=CC=CC=C2C3=[N+](C4=CC=CC=C4C=C3)C

Isomeric SMILES

CCCCCCCCCCCCOC1=CC(=CC(=C1)C)OP(=O)(O)OC2=CC=CC=C2C3=[N+](C4=CC=CC=C4C=C3)C

InChI

InChI=1S/C35H44NO5P/c1-4-5-6-7-8-9-10-11-12-17-24-39-30-25-28(2)26-31(27-30)40-42(37,38)41-35-21-16-14-19-32(35)34-23-22-29-18-13-15-20-33(29)36(34)3/h13-16,18-23,25-27H,4-12,17,24H2,1-3H3/p+1