(E)-3-(4-bromophenyl)-1-[(2R,6R)-2,6-dimethylpiperidin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(4-bromophenyl)-1-[(2R,6R)-2,6-dimethylpiperidin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(4-bromophenyl)-1-[(2R,6R)-2,6-dimethyl-1-piperidyl]prop-2-en-1-one CAS Name: (E)-3-(4-bromophenyl)-1-[(2R,6R)-2,6-dimethyl-1-piperidinyl]-2-propen-1-one IUPAC Name: (E)-3-(4-bromophenyl)-1-[(2R,6R)-2,6-dimethylpiperidin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(4-bromophenyl)-1-[(2R,6R)-2,6-dimethylpiperidino]prop-2-en-1-one Formula: C16H20BrNO MolecularWeight: 322.2401

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1C(=O)C=CC2=CC=C(C=C2)Br)C

Isomeric SMILES

C[C@@H]1CCC[C@H](N1C(=O)/C=C/C2=CC=C(C=C2)Br)C

InChI

InChI=1S/C16H20BrNO/c1-12-4-3-5-13(2)18(12)16(19)11-8-14-6-9-15(17)10-7-14/h6-13H,3-5H2,1-2H3/b11-8+/t12-,13-/m1/s1