2-methyl-5-[3-oxidanyl-2-[(phenylmethyl)amino]propyl]phenol hydrobromide

Systemtic Name: 2-methyl-5-[3-oxidanyl-2-[(phenylmethyl)amino]propyl]phenol hydrobromide Openeye Name: 5-[2-(benzylamino)-3-hydroxy-propyl]-2-methyl-phenol hydrobromide CAS Name: 5-[3-hydroxy-2-[(phenylmethyl)amino]propyl]-2-methylphenol hydrobromide IUPAC Name: 5-[2-(benzylamino)-3-hydroxypropyl]-2-methylphenol hydrobromide Traditional Name: 5-[2-(benzylamino)-3-hydroxy-propyl]-2-methyl-phenol hydrobromide Formula: C17H22BrNO2 MolecularWeight: 352.26608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CC(CO)NCC2=CC=CC=C2)O.Br

Isomeric SMILES

CC1=C(C=C(C=C1)CC(CO)NCC2=CC=CC=C2)O.Br

InChI

InChI=1S/C17H21NO2.BrH/c1-13-7-8-15(10-17(13)20)9-16(12-19)18-11-14-5-3-2-4-6-14;/h2-8,10,16,18-20H,9,11-12H2,1H3;1H