1-[4-[4-[6-(3-bromanylphenoxy)pyridin-3-yl]carbonylpiperazin-1-yl]phenyl]ethanone

Systemtic Name: 1-[4-[4-[6-(3-bromanylphenoxy)pyridin-3-yl]carbonylpiperazin-1-yl]phenyl]ethanone Openeye Name: 1-[4-[4-[6-(3-bromophenoxy)pyridine-3-carbonyl]piperazin-1-yl]phenyl]ethanone CAS Name: 1-[4-[4-[[6-(3-bromophenoxy)-3-pyridinyl]-oxomethyl]-1-piperazinyl]phenyl]ethanone IUPAC Name: 1-[4-[4-[6-(3-bromophenoxy)pyridine-3-carbonyl]piperazin-1-yl]phenyl]ethanone Traditional Name: 1-[4-[4-[6-(3-bromophenoxy)nicotinoyl]piperazino]phenyl]ethanone Formula: C24H22BrN3O3 MolecularWeight: 480.35378

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CN=C(C=C3)OC4=CC(=CC=C4)Br

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CN=C(C=C3)OC4=CC(=CC=C4)Br

InChI

InChI=1S/C24H22BrN3O3/c1-17(29)18-5-8-21(9-6-18)27-11-13-28(14-12-27)24(30)19-7-10-23(26-16-19)31-22-4-2-3-20(25)15-22/h2-10,15-16H,11-14H2,1H3