ethanedioic acid; 1-(furan-2-ylmethyl)-4-propylsulfonyl-piperazine

Systemtic Name: ethanedioic acid; 1-(furan-2-ylmethyl)-4-propylsulfonyl-piperazine Openeye Name: 1-(2-furylmethyl)-4-propylsulfonyl-piperazine; oxalic acid CAS Name: 1-(2-furanylmethyl)-4-propylsulfonylpiperazine; oxalic acid IUPAC Name: 1-(furan-2-ylmethyl)-4-propylsulfonylpiperazine; oxalic acid Traditional Name: 1-(2-furfuryl)-4-propylsulfonyl-piperazine; oxalic acid Formula: C14H22N2O7S MolecularWeight: 362.39868

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCN(CC1)CC2=CC=CO2.C(=O)(C(=O)O)O

Isomeric SMILES

CCCS(=O)(=O)N1CCN(CC1)CC2=CC=CO2.C(=O)(C(=O)O)O

InChI

InChI=1S/C12H20N2O3S.C2H2O4/c1-2-10-18(15,16)14-7-5-13(6-8-14)11-12-4-3-9-17-12;3-1(4)2(5)6/h3-4,9H,2,5-8,10-11H2,1H3;(H,3,4)(H,5,6)