2-(dimethylamino)-2-[2-(4-octylphenyl)ethyl]propane-1,3-diol

Systemtic Name: 2-(dimethylamino)-2-[2-(4-octylphenyl)ethyl]propane-1,3-diol Openeye Name: 2-(dimethylamino)-2-[2-(4-octylphenyl)ethyl]propane-1,3-diol CAS Name: 2-(dimethylamino)-2-[2-(4-octylphenyl)ethyl]propane-1,3-diol IUPAC Name: 2-(dimethylamino)-2-[2-(4-octylphenyl)ethyl]propane-1,3-diol Traditional Name: 2-(dimethylamino)-2-[2-(4-octylphenyl)ethyl]propane-1,3-diol Formula: C21H37NO2 MolecularWeight: 335.52398

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)CCC(CO)(CO)N(C)C

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)CCC(CO)(CO)N(C)C

InChI

InChI=1S/C21H37NO2/c1-4-5-6-7-8-9-10-19-11-13-20(14-12-19)15-16-21(17-23,18-24)22(2)3/h11-14,23-24H,4-10,15-18H2,1-3H3