3-[2-(methylamino)-4-octyl-phenyl]propane-1,2-diol

Systemtic Name: 3-[2-(methylamino)-4-octyl-phenyl]propane-1,2-diol Openeye Name: 3-[2-(methylamino)-4-octyl-phenyl]propane-1,2-diol CAS Name: 3-[2-(methylamino)-4-octylphenyl]propane-1,2-diol IUPAC Name: 3-[2-(methylamino)-4-octylphenyl]propane-1,2-diol Traditional Name: 3-[2-(methylamino)-4-octyl-phenyl]propane-1,2-diol Formula: C18H31NO2 MolecularWeight: 293.44424

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC(=C(C=C1)CC(CO)O)NC

Isomeric SMILES

CCCCCCCCC1=CC(=C(C=C1)CC(CO)O)NC

InChI

InChI=1S/C18H31NO2/c1-3-4-5-6-7-8-9-15-10-11-16(13-17(21)14-20)18(12-15)19-2/h10-12,17,19-21H,3-9,13-14H2,1-2H3