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

Systemtic Name: 2-[bis(2-hydroxyethyl)amino]ethanol; bis[(E)-octadec-9-enyl] hydrogen phosphate Openeye Name: 2-[bis(2-hydroxyethyl)amino]ethanol; bis[(E)-octadec-9-enyl] hydrogen phosphate CAS Name: 2-[bis(2-hydroxyethyl)amino]ethanol; bis[(E)-octadec-9-enyl] hydrogen phosphate IUPAC Name: 2-[bis(2-hydroxyethyl)amino]ethanol; bis[(E)-octadec-9-enyl] hydrogen phosphate Traditional Name: 2-[bis(2-hydroxyethyl)amino]ethanol; bis[(E)-octadec-9-enyl] hydrogen phosphate Formula: C42H86NO7P MolecularWeight: 748.108501

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C36H71O4P.C6H15NO3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-39-41(37,38)40-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;8-4-1-7(2-5-9)3-6-10/h17-20H,3-16,21-36H2,1-2H3,(H,37,38);8-10H,1-6H2/b19-17+,20-18+;