[3-(benzotriazol-1-ylmethoxy)-2-(naphthalen-1-ylmethoxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: [3-(benzotriazol-1-ylmethoxy)-2-(naphthalen-1-ylmethoxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: [3-(benzotriazol-1-ylmethoxy)-2-(1-naphthylmethoxy)propyl] 2-(trimethylammonio)ethyl phosphate CAS Name: [3-(1-benzotriazolylmethoxy)-2-(1-naphthalenylmethoxy)propyl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: [3-(benzotriazol-1-ylmethoxy)-2-(naphthalen-1-ylmethoxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: [3-(benzotriazol-1-ylmethoxy)-2-(1-naphthylmethoxy)propyl] 2-(trimethylammonio)ethyl phosphate Formula: C26H33N4O6P MolecularWeight: 528.537181

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCOP(=O)([O-])OCC(COCN1C2=CC=CC=C2N=N1)OCC3=CC=CC4=CC=CC=C43

Isomeric SMILES

C[N+](C)(C)CCOP(=O)([O-])OCC(COCN1C2=CC=CC=C2N=N1)OCC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C26H33N4O6P/c1-30(2,3)15-16-35-37(31,32)36-19-23(18-33-20-29-26-14-7-6-13-25(26)27-28-29)34-17-22-11-8-10-21-9-4-5-12-24(21)22/h4-14,23H,15-20H2,1-3H3