(8-dodecoxynaphthalen-1-yl) [3-(1,3-thiazol-3-ium-3-ylmethyl)phenyl] hydrogen phosphate

Systemtic Name: (8-dodecoxynaphthalen-1-yl) [3-(1,3-thiazol-3-ium-3-ylmethyl)phenyl] hydrogen phosphate Openeye Name: (8-dodecoxy-1-naphthyl) [3-(thiazol-3-ium-3-ylmethyl)phenyl] hydrogen phosphate CAS Name: (8-dodecoxy-1-naphthalenyl) [3-(3-thiazol-3-iumylmethyl)phenyl] hydrogen phosphate IUPAC Name: (8-dodecoxynaphthalen-1-yl) [3-(1,3-thiazol-3-ium-3-ylmethyl)phenyl] hydrogen phosphate Traditional Name: (8-lauryloxy-1-naphthyl) [3-(thiazol-3-ium-3-ylmethyl)phenyl] hydrogen phosphate Formula: C32H41NO5PS+ MolecularWeight: 582.710401

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC=CC2=C1C(=CC=C2)OP(=O)(O)OC3=CC=CC(=C3)C[N+]4=CSC=C4

Isomeric SMILES

CCCCCCCCCCCCOC1=CC=CC2=C1C(=CC=C2)OP(=O)(O)OC3=CC=CC(=C3)C[N+]4=CSC=C4

InChI

InChI=1S/C32H40NO5PS/c1-2-3-4-5-6-7-8-9-10-11-22-36-30-19-13-16-28-17-14-20-31(32(28)30)38-39(34,35)37-29-18-12-15-27(24-29)25-33-21-23-40-26-33/h12-21,23-24,26H,2-11,22,25H2,1H3/p+1