1-[4-[4-[3-(2,6-dimethylphenoxy)-2-oxidanyl-propyl]piperazin-1-yl]phenyl]ethanone

Systemtic Name: 1-[4-[4-[3-(2,6-dimethylphenoxy)-2-oxidanyl-propyl]piperazin-1-yl]phenyl]ethanone Openeye Name: 1-[4-[4-[3-(2,6-dimethylphenoxy)-2-hydroxy-propyl]piperazin-1-yl]phenyl]ethanone CAS Name: 1-[4-[4-[3-(2,6-dimethylphenoxy)-2-hydroxypropyl]-1-piperazinyl]phenyl]ethanone IUPAC Name: 1-[4-[4-[3-(2,6-dimethylphenoxy)-2-hydroxypropyl]piperazin-1-yl]phenyl]ethanone Traditional Name: 1-[4-[4-[3-(2,6-dimethylphenoxy)-2-hydroxy-propyl]piperazino]phenyl]ethanone Formula: C23H30N2O3 MolecularWeight: 382.4959

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCC(CN2CCN(CC2)C3=CC=C(C=C3)C(=O)C)O

Isomeric SMILES

CC1=C(C(=CC=C1)C)OCC(CN2CCN(CC2)C3=CC=C(C=C3)C(=O)C)O

InChI

InChI=1S/C23H30N2O3/c1-17-5-4-6-18(2)23(17)28-16-22(27)15-24-11-13-25(14-12-24)21-9-7-20(8-10-21)19(3)26/h4-10,22,27H,11-16H2,1-3H3