[(2R)-2-(2-methyloctanoylamino)-2-phenyl-ethyl] dihydrogen phosphate

Systemtic Name: [(2R)-2-(2-methyloctanoylamino)-2-phenyl-ethyl] dihydrogen phosphate Openeye Name: [(2R)-2-(2-methyloctanoylamino)-2-phenyl-ethyl] dihydrogen phosphate CAS Name: [(2R)-2-[(2-methyl-1-oxooctyl)amino]-2-phenylethyl] dihydrogen phosphate IUPAC Name: [(2R)-2-(2-methyloctanoylamino)-2-phenylethyl] dihydrogen phosphate Traditional Name: [(2R)-2-(2-methyloctanoylamino)-2-phenyl-ethyl] dihydrogen phosphate Formula: C17H28NO5P MolecularWeight: 357.381681

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)C(=O)NC(COP(=O)(O)O)C1=CC=CC=C1

Isomeric SMILES

CCCCCCC(C)C(=O)N[C@@H](COP(=O)(O)O)C1=CC=CC=C1

InChI

InChI=1S/C17H28NO5P/c1-3-4-5-7-10-14(2)17(19)18-16(13-23-24(20,21)22)15-11-8-6-9-12-15/h6,8-9,11-12,14,16H,3-5,7,10,13H2,1-2H3,(H,18,19)(H2,20,21,22)/t14?,16-/m0/s1