[2-[3-(methylsulfonylamino)phenyl]-2-(octanoylamino)ethyl] dihydrogen phosphate

Systemtic Name: [2-[3-(methylsulfonylamino)phenyl]-2-(octanoylamino)ethyl] dihydrogen phosphate Openeye Name: [2-[3-(methanesulfonamido)phenyl]-2-(octanoylamino)ethyl] dihydrogen phosphate CAS Name: [2-[3-(methanesulfonamido)phenyl]-2-(1-oxooctylamino)ethyl] dihydrogen phosphate IUPAC Name: [2-[3-(methanesulfonamido)phenyl]-2-(octanoylamino)ethyl] dihydrogen phosphate Traditional Name: [2-(caprylylamino)-2-[3-(methanesulfonamido)phenyl]ethyl] dihydrogen phosphate Formula: C17H29N2O7PS MolecularWeight: 436.460121

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC(COP(=O)(O)O)C1=CC(=CC=C1)NS(=O)(=O)C

Isomeric SMILES

CCCCCCCC(=O)NC(COP(=O)(O)O)C1=CC(=CC=C1)NS(=O)(=O)C

InChI

InChI=1S/C17H29N2O7PS/c1-3-4-5-6-7-11-17(20)18-16(13-26-27(21,22)23)14-9-8-10-15(12-14)19-28(2,24)25/h8-10,12,16,19H,3-7,11,13H2,1-2H3,(H,18,20)(H2,21,22,23)