bis(2-hydroxyethyl)-[1-(3-nonyl-2-oxidanyl-phenoxy)propyl]azanium

Systemtic Name: bis(2-hydroxyethyl)-[1-(3-nonyl-2-oxidanyl-phenoxy)propyl]azanium Openeye Name: bis(2-hydroxyethyl)-[1-(2-hydroxy-3-nonyl-phenoxy)propyl]ammonium CAS Name: bis(2-hydroxyethyl)-[1-(2-hydroxy-3-nonylphenoxy)propyl]ammonium IUPAC Name: bis(2-hydroxyethyl)-[1-(2-hydroxy-3-nonylphenoxy)propyl]azanium Traditional Name: bis(2-hydroxyethyl)-[1-(2-hydroxy-3-nonyl-phenoxy)propyl]ammonium Formula: C22H40NO4+ MolecularWeight: 382.5573

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=C(C(=CC=C1)OC(CC)[NH+](CCO)CCO)O

Isomeric SMILES

CCCCCCCCCC1=C(C(=CC=C1)OC(CC)[NH+](CCO)CCO)O

InChI

InChI=1S/C22H39NO4/c1-3-5-6-7-8-9-10-12-19-13-11-14-20(22(19)26)27-21(4-2)23(15-17-24)16-18-25/h11,13-14,21,24-26H,3-10,12,15-18H2,1-2H3/p+1