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

Systemtic Name: (4-dodecoxy-2-methyl-phenyl) [2-(1-methylquinolin-1-ium-2-yl)phenyl] hydrogen phosphate Openeye Name: (4-dodecoxy-2-methyl-phenyl) [2-(1-methylquinolin-1-ium-2-yl)phenyl] hydrogen phosphate CAS Name: (4-dodecoxy-2-methylphenyl) [2-(1-methyl-2-quinolin-1-iumyl)phenyl] hydrogen phosphate IUPAC Name: (4-dodecoxy-2-methylphenyl) [2-(1-methylquinolin-1-ium-2-yl)phenyl] hydrogen phosphate Traditional Name: (4-lauryloxy-2-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(=C(C=C1)OP(=O)(O)OC2=CC=CC=C2C3=[N+](C4=CC=CC=C4C=C3)C)C

Isomeric SMILES

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

InChI

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