3-(3-bromophenyl)-1-[4-(2,3-dimethylphenyl)piperazin-1-yl]propan-1-one

Systemtic Name: 3-(3-bromophenyl)-1-[4-(2,3-dimethylphenyl)piperazin-1-yl]propan-1-one Openeye Name: 3-(3-bromophenyl)-1-[4-(2,3-dimethylphenyl)piperazin-1-yl]propan-1-one CAS Name: 3-(3-bromophenyl)-1-[4-(2,3-dimethylphenyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-(3-bromophenyl)-1-[4-(2,3-dimethylphenyl)piperazin-1-yl]propan-1-one Traditional Name: 3-(3-bromophenyl)-1-[4-(2,3-dimethylphenyl)piperazino]propan-1-one Formula: C21H25BrN2O MolecularWeight: 401.34

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)CCC3=CC(=CC=C3)Br)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)CCC3=CC(=CC=C3)Br)C

InChI

InChI=1S/C21H25BrN2O/c1-16-5-3-8-20(17(16)2)23-11-13-24(14-12-23)21(25)10-9-18-6-4-7-19(22)15-18/h3-8,15H,9-14H2,1-2H3