[6-(3-bromophenyl)-2-methyl-pyridin-3-yl]-[4-(2-ethoxyphenyl)piperazin-1-yl]methanone

Systemtic Name: [6-(3-bromophenyl)-2-methyl-pyridin-3-yl]-[4-(2-ethoxyphenyl)piperazin-1-yl]methanone Openeye Name: [6-(3-bromophenyl)-2-methyl-3-pyridyl]-[4-(2-ethoxyphenyl)piperazin-1-yl]methanone CAS Name: [6-(3-bromophenyl)-2-methyl-3-pyridinyl]-[4-(2-ethoxyphenyl)-1-piperazinyl]methanone IUPAC Name: [6-(3-bromophenyl)-2-methylpyridin-3-yl]-[4-(2-ethoxyphenyl)piperazin-1-yl]methanone Traditional Name: [6-(3-bromophenyl)-2-methyl-3-pyridyl]-(4-o-phenetylpiperazino)methanone Formula: C25H26BrN3O2 MolecularWeight: 480.39684

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CCN(CC2)C(=O)C3=C(N=C(C=C3)C4=CC(=CC=C4)Br)C

Isomeric SMILES

CCOC1=CC=CC=C1N2CCN(CC2)C(=O)C3=C(N=C(C=C3)C4=CC(=CC=C4)Br)C

InChI

InChI=1S/C25H26BrN3O2/c1-3-31-24-10-5-4-9-23(24)28-13-15-29(16-14-28)25(30)21-11-12-22(27-18(21)2)19-7-6-8-20(26)17-19/h4-12,17H,3,13-16H2,1-2H3