[3-[[(E)-octadec-12-enoyl]amino]-2-oxidanyl-propyl] dihydrogen phosphate

Systemtic Name: [3-[[(E)-octadec-12-enoyl]amino]-2-oxidanyl-propyl] dihydrogen phosphate Openeye Name: [2-hydroxy-3-[[(E)-octadec-12-enoyl]amino]propyl] dihydrogen phosphate CAS Name: [2-hydroxy-3-[[(E)-1-oxooctadec-12-enyl]amino]propyl] dihydrogen phosphate IUPAC Name: [2-hydroxy-3-[[(E)-octadec-12-enoyl]amino]propyl] dihydrogen phosphate Traditional Name: [2-hydroxy-3-[[(E)-octadec-12-enoyl]amino]propyl] dihydrogen phosphate Formula: C21H42NO6P MolecularWeight: 435.535041

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CCCCCCCCCCCC(=O)NCC(COP(=O)(O)O)O

Isomeric SMILES

CCCCC/C=C/CCCCCCCCCCC(=O)NCC(COP(=O)(O)O)O

InChI

InChI=1S/C21H42NO6P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)22-18-20(23)19-28-29(25,26)27/h6-7,20,23H,2-5,8-19H2,1H3,(H,22,24)(H2,25,26,27)/b7-6+