1-[3-(3-chlorophenyl)-3-[2-(4-cyclohexylpiperazin-1-yl)ethyl]pyrrolidin-1-yl]-2-(3-propan-2-yloxyphenyl)ethanone

Systemtic Name: 1-[3-(3-chlorophenyl)-3-[2-(4-cyclohexylpiperazin-1-yl)ethyl]pyrrolidin-1-yl]-2-(3-propan-2-yloxyphenyl)ethanone Openeye Name: 1-[3-(3-chlorophenyl)-3-[2-(4-cyclohexylpiperazin-1-yl)ethyl]pyrrolidin-1-yl]-2-(3-isopropoxyphenyl)ethanone CAS Name: 1-[3-(3-chlorophenyl)-3-[2-(4-cyclohexyl-1-piperazinyl)ethyl]-1-pyrrolidinyl]-2-(3-propan-2-yloxyphenyl)ethanone IUPAC Name: 1-[3-(3-chlorophenyl)-3-[2-(4-cyclohexylpiperazin-1-yl)ethyl]pyrrolidin-1-yl]-2-(3-propan-2-yloxyphenyl)ethanone Traditional Name: 1-[3-(3-chlorophenyl)-3-[2-(4-cyclohexylpiperazino)ethyl]pyrrolidino]-2-(3-isopropoxyphenyl)ethanone Formula: C33H46ClN3O2 MolecularWeight: 552.19024

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC(=C1)CC(=O)N2CCC(C2)(CCN3CCN(CC3)C4CCCCC4)C5=CC(=CC=C5)Cl

Isomeric SMILES

CC(C)OC1=CC=CC(=C1)CC(=O)N2CCC(C2)(CCN3CCN(CC3)C4CCCCC4)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C33H46ClN3O2/c1-26(2)39-31-13-6-8-27(22-31)23-32(38)37-17-15-33(25-37,28-9-7-10-29(34)24-28)14-16-35-18-20-36(21-19-35)30-11-4-3-5-12-30/h6-10,13,22,24,26,30H,3-5,11-12,14-21,23,25H2,1-2H3