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

Systemtic Name: [3-(benzotriazol-1-ylmethoxy)-2-butoxy-propyl] 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: [3-(benzotriazol-1-ylmethoxy)-2-butoxy-propyl] 2-(trimethylammonio)ethyl phosphate CAS Name: [3-(1-benzotriazolylmethoxy)-2-butoxypropyl] 2-(trimethylammonio)ethyl phosphate IUPAC Name: [3-(benzotriazol-1-ylmethoxy)-2-butoxypropyl] 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: [3-(benzotriazol-1-ylmethoxy)-2-butoxy-propyl] 2-(trimethylammonio)ethyl phosphate Formula: C19H33N4O6P MolecularWeight: 444.462281

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(COCN1C2=CC=CC=C2N=N1)COP(=O)([O-])OCC[N+](C)(C)C

Isomeric SMILES

CCCCOC(COCN1C2=CC=CC=C2N=N1)COP(=O)([O-])OCC[N+](C)(C)C

InChI

InChI=1S/C19H33N4O6P/c1-5-6-12-27-17(15-29-30(24,25)28-13-11-23(2,3)4)14-26-16-22-19-10-8-7-9-18(19)20-21-22/h7-10,17H,5-6,11-16H2,1-4H3