2-[(phenylmethyl)carbamoyl-undecyl-amino]ethyl 2-(trimethylazaniumyl)ethyl phosphate

Systemtic Name: 2-[(phenylmethyl)carbamoyl-undecyl-amino]ethyl 2-(trimethylazaniumyl)ethyl phosphate Openeye Name: 2-[benzylcarbamoyl(undecyl)amino]ethyl 2-(trimethylammonio)ethyl phosphate CAS Name: 2-[[oxo-[(phenylmethyl)amino]methyl]-undecylamino]ethyl 2-(trimethylammonio)ethyl phosphate IUPAC Name: 2-[benzylcarbamoyl(undecyl)amino]ethyl 2-(trimethylazaniumyl)ethyl phosphate Traditional Name: 2-[benzylcarbamoyl(undecyl)amino]ethyl 2-(trimethylammonio)ethyl phosphate Formula: C26H48N3O5P MolecularWeight: 513.650181

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCN(CCOP(=O)([O-])OCC[N+](C)(C)C)C(=O)NCC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCN(CCOP(=O)([O-])OCC[N+](C)(C)C)C(=O)NCC1=CC=CC=C1

InChI

InChI=1S/C26H48N3O5P/c1-5-6-7-8-9-10-11-12-16-19-28(26(30)27-24-25-17-14-13-15-18-25)20-22-33-35(31,32)34-23-21-29(2,3)4/h13-15,17-18H,5-12,16,19-24H2,1-4H3,(H-,27,30,31,32)