4-[(1R)-2-azanyl-1-[(3S,5S)-3,5-dimethylpiperidin-1-yl]ethyl]-2-bromanyl-phenol

Systemtic Name: 4-[(1R)-2-azanyl-1-[(3S,5S)-3,5-dimethylpiperidin-1-yl]ethyl]-2-bromanyl-phenol Openeye Name: 4-[(1R)-2-amino-1-[(3S,5S)-3,5-dimethyl-1-piperidyl]ethyl]-2-bromo-phenol CAS Name: 4-[(1R)-2-amino-1-[(3S,5S)-3,5-dimethyl-1-piperidinyl]ethyl]-2-bromophenol IUPAC Name: 4-[(1R)-2-amino-1-[(3S,5S)-3,5-dimethylpiperidin-1-yl]ethyl]-2-bromophenol Traditional Name: 4-[(1R)-2-amino-1-[(3S,5S)-3,5-dimethylpiperidino]ethyl]-2-bromo-phenol Formula: C15H23BrN2O MolecularWeight: 327.25992

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(CN)C2=CC(=C(C=C2)O)Br)C

Isomeric SMILES

C[C@H]1C[C@@H](CN(C1)[C@@H](CN)C2=CC(=C(C=C2)O)Br)C

InChI

InChI=1S/C15H23BrN2O/c1-10-5-11(2)9-18(8-10)14(7-17)12-3-4-15(19)13(16)6-12/h3-4,6,10-11,14,19H,5,7-9,17H2,1-2H3/t10-,11-,14-/m0/s1