2-(2,6-dimethylphenyl)-2-[4-[2-(6-methyl-2,3-dihydro-1,4-benzodioxin-3-yl)-2-oxidanyl-ethyl]piperazin-1-yl]ethanamide

Systemtic Name: 2-(2,6-dimethylphenyl)-2-[4-[2-(6-methyl-2,3-dihydro-1,4-benzodioxin-3-yl)-2-oxidanyl-ethyl]piperazin-1-yl]ethanamide Openeye Name: 2-(2,6-dimethylphenyl)-2-[4-[2-hydroxy-2-(6-methyl-2,3-dihydro-1,4-benzodioxin-3-yl)ethyl]piperazin-1-yl]acetamide CAS Name: 2-(2,6-dimethylphenyl)-2-[4-[2-hydroxy-2-(6-methyl-2,3-dihydro-1,4-benzodioxin-3-yl)ethyl]-1-piperazinyl]acetamide IUPAC Name: 2-(2,6-dimethylphenyl)-2-[4-[2-hydroxy-2-(6-methyl-2,3-dihydro-1,4-benzodioxin-3-yl)ethyl]piperazin-1-yl]acetamide Traditional Name: 2-(2,6-dimethylphenyl)-2-[4-[2-hydroxy-2-(6-methyl-2,3-dihydro-1,4-benzodioxin-3-yl)ethyl]piperazino]acetamide Formula: C25H33N3O4 MolecularWeight: 439.54722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OCC(O2)C(CN3CCN(CC3)C(C4=C(C=CC=C4C)C)C(=O)N)O

Isomeric SMILES

CC1=CC2=C(C=C1)OCC(O2)C(CN3CCN(CC3)C(C4=C(C=CC=C4C)C)C(=O)N)O

InChI

InChI=1S/C25H33N3O4/c1-16-7-8-20-21(13-16)32-22(15-31-20)19(29)14-27-9-11-28(12-10-27)24(25(26)30)23-17(2)5-4-6-18(23)3/h4-8,13,19,22,24,29H,9-12,14-15H2,1-3H3,(H2,26,30)