[1-oxidanylidene-1-[4-(phenylmethyl)piperazin-1-yl]propan-2-yl] 2-(4-bromophenyl)ethanoate

Systemtic Name: [1-oxidanylidene-1-[4-(phenylmethyl)piperazin-1-yl]propan-2-yl] 2-(4-bromophenyl)ethanoate Openeye Name: [2-(4-benzylpiperazin-1-yl)-1-methyl-2-oxo-ethyl] 2-(4-bromophenyl)acetate CAS Name: 2-(4-bromophenyl)acetic acid [1-oxo-1-[4-(phenylmethyl)-1-piperazinyl]propan-2-yl] ester IUPAC Name: [1-(4-benzylpiperazin-1-yl)-1-oxopropan-2-yl] 2-(4-bromophenyl)acetate Traditional Name: 2-(4-bromophenyl)acetic acid [2-(4-benzylpiperazino)-2-keto-1-methyl-ethyl] ester Formula: C22H25BrN2O3 MolecularWeight: 445.3495

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)CC2=CC=CC=C2)OC(=O)CC3=CC=C(C=C3)Br

Isomeric SMILES

CC(C(=O)N1CCN(CC1)CC2=CC=CC=C2)OC(=O)CC3=CC=C(C=C3)Br

InChI

InChI=1S/C22H25BrN2O3/c1-17(28-21(26)15-18-7-9-20(23)10-8-18)22(27)25-13-11-24(12-14-25)16-19-5-3-2-4-6-19/h2-10,17H,11-16H2,1H3