1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-morpholin-4-yl-propan-2-ol; ethanedioic acid

Systemtic Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-morpholin-4-yl-propan-2-ol; ethanedioic acid Openeye Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-morpholino-propan-2-ol; oxalic acid CAS Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-3-(4-morpholinyl)-2-propanol; oxalic acid IUPAC Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-morpholin-4-ylpropan-2-ol; oxalic acid Traditional Name: 1-morpholino-3-(4-piperonylpiperazino)propan-2-ol; oxalic acid Formula: C21H31N3O8 MolecularWeight: 453.48614

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)CC(CN4CCOCC4)O.C(=O)(C(=O)O)O

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)CC(CN4CCOCC4)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H29N3O4.C2H2O4/c23-17(14-22-7-9-24-10-8-22)13-21-5-3-20(4-6-21)12-16-1-2-18-19(11-16)26-15-25-18;3-1(4)2(5)6/h1-2,11,17,23H,3-10,12-15H2;(H,3,4)(H,5,6)