2-[4-[3-(4-tert-butyl-2-methyl-phenoxy)-2-oxidanyl-propyl]piperazin-1-yl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[4-[3-(4-tert-butyl-2-methyl-phenoxy)-2-oxidanyl-propyl]piperazin-1-yl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[4-[3-(4-tert-butyl-2-methyl-phenoxy)-2-hydroxy-propyl]piperazin-1-yl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[4-[3-(4-tert-butyl-2-methylphenoxy)-2-hydroxypropyl]-1-piperazinyl]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[4-[3-(4-tert-butyl-2-methylphenoxy)-2-hydroxypropyl]piperazin-1-yl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[4-[3-(4-tert-butyl-2-methyl-phenoxy)-2-hydroxy-propyl]piperazino]-1-pyrrolidino-ethanone Formula: C24H39N3O3 MolecularWeight: 417.58476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(C)(C)C)OCC(CN2CCN(CC2)CC(=O)N3CCCC3)O

Isomeric SMILES

CC1=C(C=CC(=C1)C(C)(C)C)OCC(CN2CCN(CC2)CC(=O)N3CCCC3)O

InChI

InChI=1S/C24H39N3O3/c1-19-15-20(24(2,3)4)7-8-22(19)30-18-21(28)16-25-11-13-26(14-12-25)17-23(29)27-9-5-6-10-27/h7-8,15,21,28H,5-6,9-14,16-18H2,1-4H3