3-(4-bromophenyl)-1-(4-oxidanylbutylamino)-2-phenyl-hexan-3-ol hydrochloride

Systemtic Name: 3-(4-bromophenyl)-1-(4-oxidanylbutylamino)-2-phenyl-hexan-3-ol hydrochloride Openeye Name: 3-(4-bromophenyl)-1-(4-hydroxybutylamino)-2-phenyl-hexan-3-ol hydrochloride CAS Name: 3-(4-bromophenyl)-1-(4-hydroxybutylamino)-2-phenyl-3-hexanol hydrochloride IUPAC Name: 3-(4-bromophenyl)-1-(4-hydroxybutylamino)-2-phenylhexan-3-ol hydrochloride Traditional Name: 3-(4-bromophenyl)-1-(4-hydroxybutylamino)-2-phenyl-hexan-3-ol hydrochloride Formula: C22H31BrClNO2 MolecularWeight: 456.84404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=C(C=C1)Br)(C(CNCCCCO)C2=CC=CC=C2)O.Cl

Isomeric SMILES

CCCC(C1=CC=C(C=C1)Br)(C(CNCCCCO)C2=CC=CC=C2)O.Cl

InChI

InChI=1S/C22H30BrNO2.ClH/c1-2-14-22(26,19-10-12-20(23)13-11-19)21(17-24-15-6-7-16-25)18-8-4-3-5-9-18;/h3-5,8-13,21,24-26H,2,6-7,14-17H2,1H3;1H