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

Systemtic Name: 3-(4-bromophenyl)-1-(4-oxidanylbutylamino)-2-phenyl-nonan-3-ol hydrochloride Openeye Name: 3-(4-bromophenyl)-1-(4-hydroxybutylamino)-2-phenyl-nonan-3-ol hydrochloride CAS Name: 3-(4-bromophenyl)-1-(4-hydroxybutylamino)-2-phenyl-3-nonanol hydrochloride IUPAC Name: 3-(4-bromophenyl)-1-(4-hydroxybutylamino)-2-phenylnonan-3-ol hydrochloride Traditional Name: 3-(4-bromophenyl)-1-(4-hydroxybutylamino)-2-phenyl-nonan-3-ol hydrochloride Formula: C25H37BrClNO2 MolecularWeight: 498.92378

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H36BrNO2.ClH/c1-2-3-4-8-17-25(29,22-13-15-23(26)16-14-22)24(20-27-18-9-10-19-28)21-11-6-5-7-12-21;/h5-7,11-16,24,27-29H,2-4,8-10,17-20H2,1H3;1H