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

Systemtic Name: 3-(4-bromophenyl)-4-methyl-1-(4-oxidanylbutylamino)-2-phenyl-pentan-3-ol hydrochloride Openeye Name: 3-(4-bromophenyl)-1-(4-hydroxybutylamino)-4-methyl-2-phenyl-pentan-3-ol hydrochloride CAS Name: 3-(4-bromophenyl)-1-(4-hydroxybutylamino)-4-methyl-2-phenyl-3-pentanol hydrochloride IUPAC Name: 3-(4-bromophenyl)-1-(4-hydroxybutylamino)-4-methyl-2-phenylpentan-3-ol hydrochloride Traditional Name: 3-(4-bromophenyl)-1-(4-hydroxybutylamino)-4-methyl-2-phenyl-pentan-3-ol hydrochloride Formula: C22H31BrClNO2 MolecularWeight: 456.84404

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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