2-(3,4-dichlorophenyl)-1-[4-ethanoyl-2-(pyrrolidin-2-ylmethoxymethyl)piperazin-1-yl]ethanone

Systemtic Name: 2-(3,4-dichlorophenyl)-1-[4-ethanoyl-2-(pyrrolidin-2-ylmethoxymethyl)piperazin-1-yl]ethanone Openeye Name: 1-[4-acetyl-2-(pyrrolidin-2-ylmethoxymethyl)piperazin-1-yl]-2-(3,4-dichlorophenyl)ethanone CAS Name: 1-[4-acetyl-2-(2-pyrrolidinylmethoxymethyl)-1-piperazinyl]-2-(3,4-dichlorophenyl)ethanone IUPAC Name: 1-[4-acetyl-2-(pyrrolidin-2-ylmethoxymethyl)piperazin-1-yl]-2-(3,4-dichlorophenyl)ethanone Traditional Name: 1-[4-acetyl-2-(pyrrolidin-2-ylmethoxymethyl)piperazino]-2-(3,4-dichlorophenyl)ethanone Formula: C20H27Cl2N3O3 MolecularWeight: 428.35268

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(C(C1)COCC2CCCN2)C(=O)CC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CC(=O)N1CCN(C(C1)COCC2CCCN2)C(=O)CC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C20H27Cl2N3O3/c1-14(26)24-7-8-25(17(11-24)13-28-12-16-3-2-6-23-16)20(27)10-15-4-5-18(21)19(22)9-15/h4-5,9,16-17,23H,2-3,6-8,10-13H2,1H3