dihydrogen phosphate; [1-oxidanylidene-3,4-bis(2-oxidanylideneethyl)octadecan-3-yl]azanium

Systemtic Name: dihydrogen phosphate; [1-oxidanylidene-3,4-bis(2-oxidanylideneethyl)octadecan-3-yl]azanium Openeye Name: dihydrogen phosphate; 1,1,2-tris(2-oxoethyl)hexadecylammonium CAS Name: dihydrogen phosphate; [1-oxo-3,4-bis(2-oxoethyl)octadecan-3-yl]ammonium IUPAC Name: dihydrogen phosphate; [1-oxo-3,4-bis(2-oxoethyl)octadecan-3-yl]azanium Traditional Name: dihydrogen phosphate; 1,1,2-tris(2-ketoethyl)hexadecylammonium Formula: C22H44NO7P MolecularWeight: 465.561021

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(CC=O)C(CC=O)(CC=O)[NH3+].OP(=O)(O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCC(CC=O)C(CC=O)(CC=O)[NH3+].OP(=O)(O)[O-]

InChI

InChI=1S/C22H41NO3.H3O4P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-21(15-18-24)22(23,16-19-25)17-20-26;1-5(2,3)4/h18-21H,2-17,23H2,1H3;(H3,1,2,3,4)