[2-(4-bromophenyl)quinolin-4-yl]-[(2S,6S)-2,6-dimethylpiperidin-1-yl]methanone

Systemtic Name: [2-(4-bromophenyl)quinolin-4-yl]-[(2S,6S)-2,6-dimethylpiperidin-1-yl]methanone Openeye Name: [2-(4-bromophenyl)-4-quinolyl]-[(2S,6S)-2,6-dimethyl-1-piperidyl]methanone CAS Name: [2-(4-bromophenyl)-4-quinolinyl]-[(2S,6S)-2,6-dimethyl-1-piperidinyl]methanone IUPAC Name: [2-(4-bromophenyl)quinolin-4-yl]-[(2S,6S)-2,6-dimethylpiperidin-1-yl]methanone Traditional Name: [2-(4-bromophenyl)-4-quinolyl]-[(2S,6S)-2,6-dimethylpiperidino]methanone Formula: C23H23BrN2O MolecularWeight: 423.34552

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)Br)C

Isomeric SMILES

C[C@H]1CCC[C@@H](N1C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)Br)C

InChI

InChI=1S/C23H23BrN2O/c1-15-6-5-7-16(2)26(15)23(27)20-14-22(17-10-12-18(24)13-11-17)25-21-9-4-3-8-19(20)21/h3-4,8-16H,5-7H2,1-2H3/t15-,16-/m0/s1