tris(decan-3-yl)azanium phosphate

Systemtic Name: tris(decan-3-yl)azanium phosphate Openeye Name: tris(1-ethyloctyl)ammonium phosphate CAS Name: tris(decan-3-yl)ammonium phosphate IUPAC Name: tris(decan-3-yl)azanium phosphate Traditional Name: tris(1-ethyloctyl)ammonium phosphate Formula: C90H192N3O4P MolecularWeight: 1411.478941

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(CC)[NH+](C(CC)CCCCCCC)C(CC)CCCCCCC.CCCCCCCC(CC)[NH+](C(CC)CCCCCCC)C(CC)CCCCCCC.CCCCCCCC(CC)[NH+](C(CC)CCCCCCC)C(CC)CCCCCCC.[O-]P(=O)([O-])[O-]

Isomeric SMILES

CCCCCCCC(CC)[NH+](C(CC)CCCCCCC)C(CC)CCCCCCC.CCCCCCCC(CC)[NH+](C(CC)CCCCCCC)C(CC)CCCCCCC.CCCCCCCC(CC)[NH+](C(CC)CCCCCCC)C(CC)CCCCCCC.[O-]P(=O)([O-])[O-]

InChI

InChI=1S/3C30H63N.H3O4P/c3*1-7-13-16-19-22-25-28(10-4)31(29(11-5)26-23-20-17-14-8-2)30(12-6)27-24-21-18-15-9-3;1-5(2,3)4/h3*28-30H,7-27H2,1-6H3;(H3,1,2,3,4)