2-[4-[3-(2,5-dimethylphenoxy)-2-oxidanyl-propyl]piperazin-1-yl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[4-[3-(2,5-dimethylphenoxy)-2-oxidanyl-propyl]piperazin-1-yl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[4-[3-(2,5-dimethylphenoxy)-2-hydroxy-propyl]piperazin-1-yl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[4-[3-(2,5-dimethylphenoxy)-2-hydroxypropyl]-1-piperazinyl]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[4-[3-(2,5-dimethylphenoxy)-2-hydroxypropyl]piperazin-1-yl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[4-[3-(2,5-dimethylphenoxy)-2-hydroxy-propyl]piperazino]-1-pyrrolidino-ethanone Formula: C21H33N3O3 MolecularWeight: 375.50502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H33N3O3/c1-17-5-6-18(2)20(13-17)27-16-19(25)14-22-9-11-23(12-10-22)15-21(26)24-7-3-4-8-24/h5-6,13,19,25H,3-4,7-12,14-16H2,1-2H3