3-(3-bromanyl-4-methoxy-phenyl)-1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]propan-1-one

Systemtic Name: 3-(3-bromanyl-4-methoxy-phenyl)-1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]propan-1-one Openeye Name: 3-(3-bromo-4-methoxy-phenyl)-1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]propan-1-one CAS Name: 3-(3-bromo-4-methoxyphenyl)-1-[4-[(4-chlorophenyl)methyl]-1-piperazinyl]-1-propanone IUPAC Name: 3-(3-bromo-4-methoxyphenyl)-1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]propan-1-one Traditional Name: 3-(3-bromo-4-methoxy-phenyl)-1-[4-(4-chlorobenzyl)piperazino]propan-1-one Formula: C21H24BrClN2O2 MolecularWeight: 451.78446

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCC(=O)N2CCN(CC2)CC3=CC=C(C=C3)Cl)Br

Isomeric SMILES

COC1=C(C=C(C=C1)CCC(=O)N2CCN(CC2)CC3=CC=C(C=C3)Cl)Br

InChI

InChI=1S/C21H24BrClN2O2/c1-27-20-8-4-16(14-19(20)22)5-9-21(26)25-12-10-24(11-13-25)15-17-2-6-18(23)7-3-17/h2-4,6-8,14H,5,9-13,15H2,1H3