[(E)-4-[2-(dimethylamino)-1-oxidanyl-ethyl]hexacos-17-enyl]phosphonic acid

Systemtic Name: [(E)-4-[2-(dimethylamino)-1-oxidanyl-ethyl]hexacos-17-enyl]phosphonic acid Openeye Name: [(E)-4-[2-(dimethylamino)-1-hydroxy-ethyl]hexacos-17-enyl]phosphonic acid CAS Name: [(E)-4-[2-(dimethylamino)-1-hydroxyethyl]hexacos-17-enyl]phosphonic acid IUPAC Name: [(E)-4-[2-(dimethylamino)-1-hydroxyethyl]hexacos-17-enyl]phosphonic acid Traditional Name: [(E)-4-[2-(dimethylamino)-1-hydroxy-ethyl]hexacos-17-enyl]phosphonic acid Formula: C30H62NO4P MolecularWeight: 531.791341

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCCCCCC(CCCP(=O)(O)O)C(CN(C)C)O

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCCCCCC(CCCP(=O)(O)O)C(CN(C)C)O

InChI

InChI=1S/C30H62NO4P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-25-29(30(32)28-31(2)3)26-24-27-36(33,34)35/h11-12,29-30,32H,4-10,13-28H2,1-3H3,(H2,33,34,35)/b12-11+