(5-bromanylpyridin-3-yl)-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]methanone

Systemtic Name: (5-bromanylpyridin-3-yl)-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]methanone Openeye Name: (5-bromo-3-pyridyl)-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]methanone CAS Name: (5-bromo-3-pyridinyl)-[4-[(2,3,4-trimethoxyphenyl)methyl]-1-piperazinyl]methanone IUPAC Name: (5-bromopyridin-3-yl)-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]methanone Traditional Name: (5-bromo-3-pyridyl)-[4-(2,3,4-trimethoxybenzyl)piperazino]methanone Formula: C20H24BrN3O4 MolecularWeight: 450.32626

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CN2CCN(CC2)C(=O)C3=CC(=CN=C3)Br)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)CN2CCN(CC2)C(=O)C3=CC(=CN=C3)Br)OC)OC

InChI

InChI=1S/C20H24BrN3O4/c1-26-17-5-4-14(18(27-2)19(17)28-3)13-23-6-8-24(9-7-23)20(25)15-10-16(21)12-22-11-15/h4-5,10-12H,6-9,13H2,1-3H3