1-(3-bromophenyl)-2-(4-quinolin-2-ylpiperazin-1-yl)ethanone

Systemtic Name: 1-(3-bromophenyl)-2-(4-quinolin-2-ylpiperazin-1-yl)ethanone Openeye Name: 1-(3-bromophenyl)-2-[4-(2-quinolyl)piperazin-1-yl]ethanone CAS Name: 1-(3-bromophenyl)-2-[4-(2-quinolinyl)-1-piperazinyl]ethanone IUPAC Name: 1-(3-bromophenyl)-2-(4-quinolin-2-ylpiperazin-1-yl)ethanone Traditional Name: 1-(3-bromophenyl)-2-[4-(2-quinolyl)piperazino]ethanone Formula: C21H20BrN3O MolecularWeight: 410.307

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)C2=CC(=CC=C2)Br)C3=NC4=CC=CC=C4C=C3

Isomeric SMILES

C1CN(CCN1CC(=O)C2=CC(=CC=C2)Br)C3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C21H20BrN3O/c22-18-6-3-5-17(14-18)20(26)15-24-10-12-25(13-11-24)21-9-8-16-4-1-2-7-19(16)23-21/h1-9,14H,10-13,15H2