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

Systemtic Name: 2-azanyl-2-[2-(4-octylphenyl)ethyl]pentane-1,5-diol hydrochloride Openeye Name: 2-amino-2-[2-(4-octylphenyl)ethyl]pentane-1,5-diol hydrochloride CAS Name: 2-amino-2-[2-(4-octylphenyl)ethyl]pentane-1,5-diol hydrochloride IUPAC Name: 2-amino-2-[2-(4-octylphenyl)ethyl]pentane-1,5-diol hydrochloride Traditional Name: 2-amino-2-[2-(4-octylphenyl)ethyl]pentane-1,5-diol hydrochloride Formula: C21H38ClNO2 MolecularWeight: 371.98492

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)CCC(CCCO)(CO)N.Cl

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)CCC(CCCO)(CO)N.Cl

InChI

InChI=1S/C21H37NO2.ClH/c1-2-3-4-5-6-7-9-19-10-12-20(13-11-19)14-16-21(22,18-24)15-8-17-23;/h10-13,23-24H,2-9,14-18,22H2,1H3;1H