1-[2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-2-[4-(phenylmethyl)piperazin-1-yl]ethanone

Systemtic Name: 1-[2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]-2-[4-(phenylmethyl)piperazin-1-yl]ethanone Openeye Name: 2-(4-benzylpiperazin-1-yl)-1-[2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]ethanone CAS Name: 1-[2-(2,5-dimethoxyphenyl)-1-pyrrolidinyl]-2-[4-(phenylmethyl)-1-piperazinyl]ethanone IUPAC Name: 2-(4-benzylpiperazin-1-yl)-1-[2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]ethanone Traditional Name: 2-(4-benzylpiperazino)-1-[2-(2,5-dimethoxyphenyl)pyrrolidino]ethanone Formula: C25H33N3O3 MolecularWeight: 423.54782

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C2CCCN2C(=O)CN3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C2CCCN2C(=O)CN3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C25H33N3O3/c1-30-21-10-11-24(31-2)22(17-21)23-9-6-12-28(23)25(29)19-27-15-13-26(14-16-27)18-20-7-4-3-5-8-20/h3-5,7-8,10-11,17,23H,6,9,12-16,18-19H2,1-2H3