4-[4-[(2S)-3-(3-bromanylphenoxy)-2-oxidanyl-propyl]piperazin-1-yl]phenol

Systemtic Name: 4-[4-[(2S)-3-(3-bromanylphenoxy)-2-oxidanyl-propyl]piperazin-1-yl]phenol Openeye Name: 4-[4-[(2S)-3-(3-bromophenoxy)-2-hydroxy-propyl]piperazin-1-yl]phenol CAS Name: 4-[4-[(2S)-3-(3-bromophenoxy)-2-hydroxypropyl]-1-piperazinyl]phenol IUPAC Name: 4-[4-[(2S)-3-(3-bromophenoxy)-2-hydroxypropyl]piperazin-1-yl]phenol Traditional Name: 4-[4-[(2S)-3-(3-bromophenoxy)-2-hydroxy-propyl]piperazino]phenol Formula: C19H23BrN2O3 MolecularWeight: 407.30152

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(COC2=CC(=CC=C2)Br)O)C3=CC=C(C=C3)O

Isomeric SMILES

C1CN(CCN1C[C@@H](COC2=CC(=CC=C2)Br)O)C3=CC=C(C=C3)O

InChI

InChI=1S/C19H23BrN2O3/c20-15-2-1-3-19(12-15)25-14-18(24)13-21-8-10-22(11-9-21)16-4-6-17(23)7-5-16/h1-7,12,18,23-24H,8-11,13-14H2/t18-/m0/s1