2-[(1S)-2-azanyl-1-(4-methylpiperazin-1-yl)ethyl]-4-bromanyl-phenol

Systemtic Name: 2-[(1S)-2-azanyl-1-(4-methylpiperazin-1-yl)ethyl]-4-bromanyl-phenol Openeye Name: 2-[(1S)-2-amino-1-(4-methylpiperazin-1-yl)ethyl]-4-bromo-phenol CAS Name: 2-[(1S)-2-amino-1-(4-methyl-1-piperazinyl)ethyl]-4-bromophenol IUPAC Name: 2-[(1S)-2-amino-1-(4-methylpiperazin-1-yl)ethyl]-4-bromophenol Traditional Name: 2-[(1S)-2-amino-1-(4-methylpiperazino)ethyl]-4-bromo-phenol Formula: C13H20BrN3O MolecularWeight: 314.2214

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(CN)C2=C(C=CC(=C2)Br)O

Isomeric SMILES

CN1CCN(CC1)[C@H](CN)C2=C(C=CC(=C2)Br)O

InChI

InChI=1S/C13H20BrN3O/c1-16-4-6-17(7-5-16)12(9-15)11-8-10(14)2-3-13(11)18/h2-3,8,12,18H,4-7,9,15H2,1H3/t12-/m1/s1