[2-(3-cyclopentyloxyphenyl)-2-(octanoylamino)ethyl] dihydrogen phosphate

Systemtic Name: [2-(3-cyclopentyloxyphenyl)-2-(octanoylamino)ethyl] dihydrogen phosphate Openeye Name: [2-[3-(cyclopentoxy)phenyl]-2-(octanoylamino)ethyl] dihydrogen phosphate CAS Name: [2-(3-cyclopentyloxyphenyl)-2-(1-oxooctylamino)ethyl] dihydrogen phosphate IUPAC Name: [2-(3-cyclopentyloxyphenyl)-2-(octanoylamino)ethyl] dihydrogen phosphate Traditional Name: [2-(caprylylamino)-2-[3-(cyclopentoxy)phenyl]ethyl] dihydrogen phosphate Formula: C21H34NO6P MolecularWeight: 427.471521

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC(COP(=O)(O)O)C1=CC(=CC=C1)OC2CCCC2

Isomeric SMILES

CCCCCCCC(=O)NC(COP(=O)(O)O)C1=CC(=CC=C1)OC2CCCC2

InChI

InChI=1S/C21H34NO6P/c1-2-3-4-5-6-14-21(23)22-20(16-27-29(24,25)26)17-10-9-13-19(15-17)28-18-11-7-8-12-18/h9-10,13,15,18,20H,2-8,11-12,14,16H2,1H3,(H,22,23)(H2,24,25,26)