[1-[2-(4-bromanylphenoxy)pyridin-3-yl]carbonylpiperidin-4-yl]-(2,4-dimethylphenyl)methanone

Systemtic Name: [1-[2-(4-bromanylphenoxy)pyridin-3-yl]carbonylpiperidin-4-yl]-(2,4-dimethylphenyl)methanone Openeye Name: [1-[2-(4-bromophenoxy)pyridine-3-carbonyl]-4-piperidyl]-(2,4-dimethylphenyl)methanone CAS Name: [1-[[2-(4-bromophenoxy)-3-pyridinyl]-oxomethyl]-4-piperidinyl]-(2,4-dimethylphenyl)methanone IUPAC Name: [1-[2-(4-bromophenoxy)pyridine-3-carbonyl]piperidin-4-yl]-(2,4-dimethylphenyl)methanone Traditional Name: [1-[2-(4-bromophenoxy)nicotinoyl]-4-piperidyl]-(2,4-dimethylphenyl)methanone Formula: C26H25BrN2O3 MolecularWeight: 493.3923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)C2CCN(CC2)C(=O)C3=C(N=CC=C3)OC4=CC=C(C=C4)Br)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)C2CCN(CC2)C(=O)C3=C(N=CC=C3)OC4=CC=C(C=C4)Br)C

InChI

InChI=1S/C26H25BrN2O3/c1-17-5-10-22(18(2)16-17)24(30)19-11-14-29(15-12-19)26(31)23-4-3-13-28-25(23)32-21-8-6-20(27)7-9-21/h3-10,13,16,19H,11-12,14-15H2,1-2H3