(octanoylamino) 2-(3-propoxyphenyl)ethyl hydrogen phosphate

Systemtic Name: (octanoylamino) 2-(3-propoxyphenyl)ethyl hydrogen phosphate Openeye Name: (octanoylamino) 2-(3-propoxyphenyl)ethyl hydrogen phosphate CAS Name: (1-oxooctylamino) 2-(3-propoxyphenyl)ethyl hydrogen phosphate IUPAC Name: (octanoylamino) 2-(3-propoxyphenyl)ethyl hydrogen phosphate Traditional Name: (caprylylamino) 2-(3-propoxyphenyl)ethyl hydrogen phosphate Formula: C19H32NO6P MolecularWeight: 401.434241

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NOP(=O)(O)OCCC1=CC(=CC=C1)OCCC

Isomeric SMILES

CCCCCCCC(=O)NOP(=O)(O)OCCC1=CC(=CC=C1)OCCC

InChI

InChI=1S/C19H32NO6P/c1-3-5-6-7-8-12-19(21)20-26-27(22,23)25-15-13-17-10-9-11-18(16-17)24-14-4-2/h9-11,16H,3-8,12-15H2,1-2H3,(H,20,21)(H,22,23)