[3-(2-dodecoxyphenoxy)-2-methoxy-propyl] [2-(1,3-thiazol-3-ium-3-ylmethyl)phenyl] hydrogen phosphate

Systemtic Name: [3-(2-dodecoxyphenoxy)-2-methoxy-propyl] [2-(1,3-thiazol-3-ium-3-ylmethyl)phenyl] hydrogen phosphate Openeye Name: [3-(2-dodecoxyphenoxy)-2-methoxy-propyl] [2-(thiazol-3-ium-3-ylmethyl)phenyl] hydrogen phosphate CAS Name: [3-(2-dodecoxyphenoxy)-2-methoxypropyl] [2-(3-thiazol-3-iumylmethyl)phenyl] hydrogen phosphate IUPAC Name: [3-(2-dodecoxyphenoxy)-2-methoxypropyl] [2-(1,3-thiazol-3-ium-3-ylmethyl)phenyl] hydrogen phosphate Traditional Name: [3-(2-lauryloxyphenoxy)-2-methoxy-propyl] [2-(thiazol-3-ium-3-ylmethyl)phenyl] hydrogen phosphate Formula: C32H47NO7PS+ MolecularWeight: 620.756841

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC=CC=C1OCC(COP(=O)(O)OC2=CC=CC=C2C[N+]3=CSC=C3)OC

Isomeric SMILES

CCCCCCCCCCCCOC1=CC=CC=C1OCC(COP(=O)(O)OC2=CC=CC=C2C[N+]3=CSC=C3)OC

InChI

InChI=1S/C32H46NO7PS/c1-3-4-5-6-7-8-9-10-11-16-22-37-31-19-14-15-20-32(31)38-25-29(36-2)26-39-41(34,35)40-30-18-13-12-17-28(30)24-33-21-23-42-27-33/h12-15,17-21,23,27,29H,3-11,16,22,24-26H2,1-2H3/p+1