[2-ethoxy-3-(7-tridecoxynaphthalen-2-yl)oxy-propyl] [3-(1,3-thiazol-3-ium-3-ylmethyl)phenyl] hydrogen phosphate

Systemtic Name: [2-ethoxy-3-(7-tridecoxynaphthalen-2-yl)oxy-propyl] [3-(1,3-thiazol-3-ium-3-ylmethyl)phenyl] hydrogen phosphate Openeye Name: [2-ethoxy-3-[(7-tridecoxy-2-naphthyl)oxy]propyl] [3-(thiazol-3-ium-3-ylmethyl)phenyl] hydrogen phosphate CAS Name: [2-ethoxy-3-[(7-tridecoxy-2-naphthalenyl)oxy]propyl] [3-(3-thiazol-3-iumylmethyl)phenyl] hydrogen phosphate IUPAC Name: [2-ethoxy-3-(7-tridecoxynaphthalen-2-yl)oxypropyl] [3-(1,3-thiazol-3-ium-3-ylmethyl)phenyl] hydrogen phosphate Traditional Name: [2-ethoxy-3-(7-tridecoxy-2-naphthoxy)propyl] [3-(thiazol-3-ium-3-ylmethyl)phenyl] hydrogen phosphate Formula: C38H53NO7PS+ MolecularWeight: 698.868681

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCOC1=CC2=C(C=C1)C=CC(=C2)OCC(COP(=O)(O)OC3=CC=CC(=C3)C[N+]4=CSC=C4)OCC

Isomeric SMILES

CCCCCCCCCCCCCOC1=CC2=C(C=C1)C=CC(=C2)OCC(COP(=O)(O)OC3=CC=CC(=C3)C[N+]4=CSC=C4)OCC

InChI

InChI=1S/C38H52NO7PS/c1-3-5-6-7-8-9-10-11-12-13-14-23-43-35-20-18-33-19-21-36(27-34(33)26-35)44-29-38(42-4-2)30-45-47(40,41)46-37-17-15-16-32(25-37)28-39-22-24-48-31-39/h15-22,24-27,31,38H,3-14,23,28-30H2,1-2H3/p+1