6-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-oxidanyl-ethyl]-3-methyl-1,3-benzoxazol-2-one

Systemtic Name: 6-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-oxidanyl-ethyl]-3-methyl-1,3-benzoxazol-2-one Openeye Name: 6-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-hydroxy-ethyl]-3-methyl-1,3-benzoxazol-2-one CAS Name: 6-[2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-1-hydroxyethyl]-3-methyl-1,3-benzoxazol-2-one IUPAC Name: 6-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-hydroxyethyl]-3-methyl-1,3-benzoxazol-2-one Traditional Name: 6-[1-hydroxy-2-(4-piperonylpiperazino)ethyl]-3-methyl-1,3-benzoxazol-2-one Formula: C22H25N3O5 MolecularWeight: 411.451

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C(CN3CCN(CC3)CC4=CC5=C(C=C4)OCO5)O)OC1=O

Isomeric SMILES

CN1C2=C(C=C(C=C2)C(CN3CCN(CC3)CC4=CC5=C(C=C4)OCO5)O)OC1=O

InChI

InChI=1S/C22H25N3O5/c1-23-17-4-3-16(11-20(17)30-22(23)27)18(26)13-25-8-6-24(7-9-25)12-15-2-5-19-21(10-15)29-14-28-19/h2-5,10-11,18,26H,6-9,12-14H2,1H3