1-[4-[2-(3-bromanylphenoxy)pyridin-3-yl]carbonylpiperazin-1-yl]-2-morpholin-4-yl-ethanone

Systemtic Name: 1-[4-[2-(3-bromanylphenoxy)pyridin-3-yl]carbonylpiperazin-1-yl]-2-morpholin-4-yl-ethanone Openeye Name: 1-[4-[2-(3-bromophenoxy)pyridine-3-carbonyl]piperazin-1-yl]-2-morpholino-ethanone CAS Name: 1-[4-[[2-(3-bromophenoxy)-3-pyridinyl]-oxomethyl]-1-piperazinyl]-2-(4-morpholinyl)ethanone IUPAC Name: 1-[4-[2-(3-bromophenoxy)pyridine-3-carbonyl]piperazin-1-yl]-2-morpholin-4-ylethanone Traditional Name: 1-[4-[2-(3-bromophenoxy)nicotinoyl]piperazino]-2-morpholino-ethanone Formula: C22H25BrN4O4 MolecularWeight: 489.3623

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CN2CCOCC2)C(=O)C3=C(N=CC=C3)OC4=CC(=CC=C4)Br

Isomeric SMILES

C1CN(CCN1C(=O)CN2CCOCC2)C(=O)C3=C(N=CC=C3)OC4=CC(=CC=C4)Br

InChI

InChI=1S/C22H25BrN4O4/c23-17-3-1-4-18(15-17)31-21-19(5-2-6-24-21)22(29)27-9-7-26(8-10-27)20(28)16-25-11-13-30-14-12-25/h1-6,15H,7-14,16H2