[1-[(4-bromanylphenoxy)methyl]pyrazol-3-yl]-[(2S)-2-methylpiperidin-1-yl]methanone

Systemtic Name: [1-[(4-bromanylphenoxy)methyl]pyrazol-3-yl]-[(2S)-2-methylpiperidin-1-yl]methanone Openeye Name: [1-[(4-bromophenoxy)methyl]pyrazol-3-yl]-[(2S)-2-methyl-1-piperidyl]methanone CAS Name: [1-[(4-bromophenoxy)methyl]-3-pyrazolyl]-[(2S)-2-methyl-1-piperidinyl]methanone IUPAC Name: [1-[(4-bromophenoxy)methyl]pyrazol-3-yl]-[(2S)-2-methylpiperidin-1-yl]methanone Traditional Name: [1-[(4-bromophenoxy)methyl]pyrazol-3-yl]-[(2S)-2-methylpiperidino]methanone Formula: C17H20BrN3O2 MolecularWeight: 378.2636

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)C2=NN(C=C2)COC3=CC=C(C=C3)Br

Isomeric SMILES

C[C@H]1CCCCN1C(=O)C2=NN(C=C2)COC3=CC=C(C=C3)Br

InChI

InChI=1S/C17H20BrN3O2/c1-13-4-2-3-10-21(13)17(22)16-9-11-20(19-16)12-23-15-7-5-14(18)6-8-15/h5-9,11,13H,2-4,10,12H2,1H3/t13-/m0/s1