3-azanyl-3-[2-(4-octylphenyl)ethyl]pentane-1,5-diol

Systemtic Name: 3-azanyl-3-[2-(4-octylphenyl)ethyl]pentane-1,5-diol Openeye Name: 3-amino-3-[2-(4-octylphenyl)ethyl]pentane-1,5-diol CAS Name: 3-amino-3-[2-(4-octylphenyl)ethyl]pentane-1,5-diol IUPAC Name: 3-amino-3-[2-(4-octylphenyl)ethyl]pentane-1,5-diol Traditional Name: 3-amino-3-[2-(4-octylphenyl)ethyl]pentane-1,5-diol Formula: C21H37NO2 MolecularWeight: 335.52398

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H37NO2/c1-2-3-4-5-6-7-8-19-9-11-20(12-10-19)13-14-21(22,15-17-23)16-18-24/h9-12,23-24H,2-8,13-18,22H2,1H3