2-[bis(2-hydroxyethyl)amino]ethanol; [(E)-octadec-9-enyl] dihydrogen phosphate

Systemtic Name: 2-[bis(2-hydroxyethyl)amino]ethanol; [(E)-octadec-9-enyl] dihydrogen phosphate Openeye Name: 2-[bis(2-hydroxyethyl)amino]ethanol; [(E)-octadec-9-enyl] dihydrogen phosphate CAS Name: 2-[bis(2-hydroxyethyl)amino]ethanol; [(E)-octadec-9-enyl] dihydrogen phosphate IUPAC Name: 2-[bis(2-hydroxyethyl)amino]ethanol; [(E)-octadec-9-enyl] dihydrogen phosphate Traditional Name: 2-[bis(2-hydroxyethyl)amino]ethanol; [(E)-octadec-9-enyl] dihydrogen phosphate Formula: C30H67N2O10P MolecularWeight: 646.834141

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCOP(=O)(O)O.C(CO)N(CCO)CCO.C(CO)N(CCO)CCO

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCOP(=O)(O)O.C(CO)N(CCO)CCO.C(CO)N(CCO)CCO

InChI

InChI=1S/C18H37O4P.2C6H15NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-23(19,20)21;2*8-4-1-7(2-5-9)3-6-10/h9-10H,2-8,11-18H2,1H3,(H2,19,20,21);2*8-10H,1-6H2/b10-9+;;