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

Systemtic Name: 2-[2-azanyl-2-(4-octylphenyl)ethyl]pentane-1,5-diol Openeye Name: 2-[2-amino-2-(4-octylphenyl)ethyl]pentane-1,5-diol CAS Name: 2-[2-amino-2-(4-octylphenyl)ethyl]pentane-1,5-diol IUPAC Name: 2-[2-amino-2-(4-octylphenyl)ethyl]pentane-1,5-diol Traditional Name: 2-[2-amino-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)C(CC(CCCO)CO)N

Isomeric SMILES

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

InChI

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