[2-azanyl-2-[2-(4-heptoxyphenyl)ethyl]-5-oxidanyl-pentyl] dihydrogen phosphate

Systemtic Name: [2-azanyl-2-[2-(4-heptoxyphenyl)ethyl]-5-oxidanyl-pentyl] dihydrogen phosphate Openeye Name: [2-amino-2-[2-(4-heptoxyphenyl)ethyl]-5-hydroxy-pentyl] dihydrogen phosphate CAS Name: [2-amino-2-[2-(4-heptoxyphenyl)ethyl]-5-hydroxypentyl] dihydrogen phosphate IUPAC Name: [2-amino-2-[2-(4-heptoxyphenyl)ethyl]-5-hydroxypentyl] dihydrogen phosphate Traditional Name: [2-amino-2-[2-(4-heptoxyphenyl)ethyl]-5-hydroxy-pentyl] dihydrogen phosphate Formula: C20H36NO6P MolecularWeight: 417.476701

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)CCC(CCCO)(COP(=O)(O)O)N

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)CCC(CCCO)(COP(=O)(O)O)N

InChI

InChI=1S/C20H36NO6P/c1-2-3-4-5-6-16-26-19-10-8-18(9-11-19)12-14-20(21,13-7-15-22)17-27-28(23,24)25/h8-11,22H,2-7,12-17,21H2,1H3,(H2,23,24,25)