2-(4-bromanyl-3,5-dimethyl-phenoxy)-1-[4-(4-methoxyphenyl)piperazin-1-yl]ethanone

Systemtic Name: 2-(4-bromanyl-3,5-dimethyl-phenoxy)-1-[4-(4-methoxyphenyl)piperazin-1-yl]ethanone Openeye Name: 2-(4-bromo-3,5-dimethyl-phenoxy)-1-[4-(4-methoxyphenyl)piperazin-1-yl]ethanone CAS Name: 2-(4-bromo-3,5-dimethylphenoxy)-1-[4-(4-methoxyphenyl)-1-piperazinyl]ethanone IUPAC Name: 2-(4-bromo-3,5-dimethylphenoxy)-1-[4-(4-methoxyphenyl)piperazin-1-yl]ethanone Traditional Name: 2-(4-bromo-3,5-dimethyl-phenoxy)-1-[4-(4-methoxyphenyl)piperazino]ethanone Formula: C21H25BrN2O3 MolecularWeight: 433.3388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Br)C)OCC(=O)N2CCN(CC2)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC(=CC(=C1Br)C)OCC(=O)N2CCN(CC2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H25BrN2O3/c1-15-12-19(13-16(2)21(15)22)27-14-20(25)24-10-8-23(9-11-24)17-4-6-18(26-3)7-5-17/h4-7,12-13H,8-11,14H2,1-3H3