1,2-diphenylethyl (octanoylamino) hydrogen phosphate

Systemtic Name: 1,2-diphenylethyl (octanoylamino) hydrogen phosphate Openeye Name: 1,2-diphenylethyl (octanoylamino) hydrogen phosphate CAS Name: 1,2-diphenylethyl (1-oxooctylamino) hydrogen phosphate IUPAC Name: 1,2-diphenylethyl (octanoylamino) hydrogen phosphate Traditional Name: (caprylylamino) 1,2-diphenylethyl hydrogen phosphate Formula: C22H30NO5P MolecularWeight: 419.451061

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NOP(=O)(O)OC(CC1=CC=CC=C1)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCC(=O)NOP(=O)(O)OC(CC1=CC=CC=C1)C2=CC=CC=C2

InChI

InChI=1S/C22H30NO5P/c1-2-3-4-5-12-17-22(24)23-28-29(25,26)27-21(20-15-10-7-11-16-20)18-19-13-8-6-9-14-19/h6-11,13-16,21H,2-5,12,17-18H2,1H3,(H,23,24)(H,25,26)