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

Systemtic Name: 2-[4-[3-(2,5-dimethylphenoxy)-2-oxidanyl-propyl]piperazin-1-yl]-1-(2-methylpiperidin-1-yl)ethanone Openeye Name: 2-[4-[3-(2,5-dimethylphenoxy)-2-hydroxy-propyl]piperazin-1-yl]-1-(2-methyl-1-piperidyl)ethanone CAS Name: 2-[4-[3-(2,5-dimethylphenoxy)-2-hydroxypropyl]-1-piperazinyl]-1-(2-methyl-1-piperidinyl)ethanone IUPAC Name: 2-[4-[3-(2,5-dimethylphenoxy)-2-hydroxypropyl]piperazin-1-yl]-1-(2-methylpiperidin-1-yl)ethanone Traditional Name: 2-[4-[3-(2,5-dimethylphenoxy)-2-hydroxy-propyl]piperazino]-1-(2-methylpiperidino)ethanone Formula: C23H37N3O3 MolecularWeight: 403.55818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)CN2CCN(CC2)CC(COC3=C(C=CC(=C3)C)C)O

Isomeric SMILES

CC1CCCCN1C(=O)CN2CCN(CC2)CC(COC3=C(C=CC(=C3)C)C)O

InChI

InChI=1S/C23H37N3O3/c1-18-7-8-19(2)22(14-18)29-17-21(27)15-24-10-12-25(13-11-24)16-23(28)26-9-5-4-6-20(26)3/h7-8,14,20-21,27H,4-6,9-13,15-17H2,1-3H3