(3-dodecoxy-5-methoxy-phenyl) [2-(quinolin-1-ium-1-ylmethyl)phenyl] hydrogen phosphate

Systemtic Name: (3-dodecoxy-5-methoxy-phenyl) [2-(quinolin-1-ium-1-ylmethyl)phenyl] hydrogen phosphate Openeye Name: (3-dodecoxy-5-methoxy-phenyl) [2-(quinolin-1-ium-1-ylmethyl)phenyl] hydrogen phosphate CAS Name: (3-dodecoxy-5-methoxyphenyl) [2-(1-quinolin-1-iumylmethyl)phenyl] hydrogen phosphate IUPAC Name: (3-dodecoxy-5-methoxyphenyl) [2-(quinolin-1-ium-1-ylmethyl)phenyl] hydrogen phosphate Traditional Name: (3-lauryloxy-5-methoxy-phenyl) [2-(quinolin-1-ium-1-ylmethyl)phenyl] hydrogen phosphate Formula: C35H45NO6P+ MolecularWeight: 606.708661

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC(=CC(=C1)OC)OP(=O)(O)OC2=CC=CC=C2C[N+]3=CC=CC4=CC=CC=C43

Isomeric SMILES

CCCCCCCCCCCCOC1=CC(=CC(=C1)OC)OP(=O)(O)OC2=CC=CC=C2C[N+]3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C35H44NO6P/c1-3-4-5-6-7-8-9-10-11-16-24-40-32-25-31(39-2)26-33(27-32)41-43(37,38)42-35-22-15-13-19-30(35)28-36-23-17-20-29-18-12-14-21-34(29)36/h12-15,17-23,25-27H,3-11,16,24,28H2,1-2H3/p+1