[(E)-octadec-9-enoyl] phosphate; N-octyloctan-1-amine

Systemtic Name: [(E)-octadec-9-enoyl] phosphate; N-octyloctan-1-amine Openeye Name: [(E)-octadec-9-enoyl] phosphate; N-octyloctan-1-amine CAS Name: N-octyl-1-octanamine; [(E)-1-oxooctadec-9-enyl] phosphate IUPAC Name: [(E)-octadec-9-enoyl] phosphate; N-octyloctan-1-amine Traditional Name: dioctylamine; [(E)-octadec-9-enoyl] phosphate Formula: C34H68NO5P-2 MolecularWeight: 601.881181

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)OP(=O)([O-])[O-].CCCCCCCCNCCCCCCCC

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)OP(=O)([O-])[O-].CCCCCCCCNCCCCCCCC

InChI

InChI=1S/C18H35O5P.C16H35N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)23-24(20,21)22;1-3-5-7-9-11-13-15-17-16-14-12-10-8-6-4-2/h9-10H,2-8,11-17H2,1H3,(H2,20,21,22);17H,3-16H2,1-2H3/p-2/b10-9+;