ethanedioic acid; 1-(furan-2-ylmethoxy)-3-(4-phenylpiperazin-1-yl)propan-2-ol

Systemtic Name: ethanedioic acid; 1-(furan-2-ylmethoxy)-3-(4-phenylpiperazin-1-yl)propan-2-ol Openeye Name: 1-(2-furylmethoxy)-3-(4-phenylpiperazin-1-yl)propan-2-ol; oxalic acid CAS Name: 1-(2-furanylmethoxy)-3-(4-phenyl-1-piperazinyl)-2-propanol; oxalic acid IUPAC Name: 1-(furan-2-ylmethoxy)-3-(4-phenylpiperazin-1-yl)propan-2-ol; oxalic acid Traditional Name: 1-(2-furfuryloxy)-3-(4-phenylpiperazino)propan-2-ol; oxalic acid Formula: C20H26N2O7 MolecularWeight: 406.42964

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(COCC2=CC=CO2)O)C3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

C1CN(CCN1CC(COCC2=CC=CO2)O)C3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H24N2O3.C2H2O4/c21-17(14-22-15-18-7-4-12-23-18)13-19-8-10-20(11-9-19)16-5-2-1-3-6-16;3-1(4)2(5)6/h1-7,12,17,21H,8-11,13-15H2;(H,3,4)(H,5,6)