[2-(dimethylamino)-2-methyl-4-(4-octylphenyl)butyl] dihydrogen phosphate

Systemtic Name: [2-(dimethylamino)-2-methyl-4-(4-octylphenyl)butyl] dihydrogen phosphate Openeye Name: [2-(dimethylamino)-2-methyl-4-(4-octylphenyl)butyl] dihydrogen phosphate CAS Name: [2-(dimethylamino)-2-methyl-4-(4-octylphenyl)butyl] dihydrogen phosphate IUPAC Name: [2-(dimethylamino)-2-methyl-4-(4-octylphenyl)butyl] dihydrogen phosphate Traditional Name: [2-(dimethylamino)-2-methyl-4-(4-octylphenyl)butyl] dihydrogen phosphate Formula: C21H38NO4P MolecularWeight: 399.504481

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)CCC(C)(COP(=O)(O)O)N(C)C

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)CCC(C)(COP(=O)(O)O)N(C)C

InChI

InChI=1S/C21H38NO4P/c1-5-6-7-8-9-10-11-19-12-14-20(15-13-19)16-17-21(2,22(3)4)18-26-27(23,24)25/h12-15H,5-11,16-18H2,1-4H3,(H2,23,24,25)