3-[2-(methylamino)-4,5-dipentyl-phenyl]propane-1,2-diol

Systemtic Name: 3-[2-(methylamino)-4,5-dipentyl-phenyl]propane-1,2-diol Openeye Name: 3-[2-(methylamino)-4,5-dipentyl-phenyl]propane-1,2-diol CAS Name: 3-[2-(methylamino)-4,5-dipentylphenyl]propane-1,2-diol IUPAC Name: 3-[2-(methylamino)-4,5-dipentylphenyl]propane-1,2-diol Traditional Name: 3-[4,5-diamyl-2-(methylamino)phenyl]propane-1,2-diol Formula: C20H35NO2 MolecularWeight: 321.4974

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC(=C(C=C1CCCCC)NC)CC(CO)O

Isomeric SMILES

CCCCCC1=CC(=C(C=C1CCCCC)NC)CC(CO)O

InChI

InChI=1S/C20H35NO2/c1-4-6-8-10-16-12-18(13-19(23)15-22)20(21-3)14-17(16)11-9-7-5-2/h12,14,19,21-23H,4-11,13,15H2,1-3H3