2-(2-bromanyl-4-methyl-phenoxy)-1-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethanone

Systemtic Name: 2-(2-bromanyl-4-methyl-phenoxy)-1-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethanone Openeye Name: 2-(2-bromo-4-methyl-phenoxy)-1-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethanone CAS Name: 2-(2-bromo-4-methylphenoxy)-1-[4-(2,3-dimethylphenyl)-1-piperazinyl]ethanone IUPAC Name: 2-(2-bromo-4-methylphenoxy)-1-[4-(2,3-dimethylphenyl)piperazin-1-yl]ethanone Traditional Name: 2-(2-bromo-4-methyl-phenoxy)-1-[4-(2,3-dimethylphenyl)piperazino]ethanone Formula: C21H25BrN2O2 MolecularWeight: 417.3394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC(=O)N2CCN(CC2)C3=CC=CC(=C3C)C)Br

Isomeric SMILES

CC1=CC(=C(C=C1)OCC(=O)N2CCN(CC2)C3=CC=CC(=C3C)C)Br

InChI

InChI=1S/C21H25BrN2O2/c1-15-7-8-20(18(22)13-15)26-14-21(25)24-11-9-23(10-12-24)19-6-4-5-16(2)17(19)3/h4-8,13H,9-12,14H2,1-3H3