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

Systemtic Name: ethanedioic acid; 1-(furan-2-ylmethyl)-4-(phenylmethyl)piperazine Openeye Name: 1-benzyl-4-(2-furylmethyl)piperazine; oxalic acid CAS Name: 1-(2-furanylmethyl)-4-(phenylmethyl)piperazine; oxalic acid IUPAC Name: 1-benzyl-4-(furan-2-ylmethyl)piperazine; oxalic acid Traditional Name: 1-benzyl-4-(2-furfuryl)piperazine; oxalic acid Formula: C18H22N2O5 MolecularWeight: 346.37768

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)CC3=CC=CO3.C(=O)(C(=O)O)O

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)CC3=CC=CO3.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H20N2O.C2H2O4/c1-2-5-15(6-3-1)13-17-8-10-18(11-9-17)14-16-7-4-12-19-16;3-1(4)2(5)6/h1-7,12H,8-11,13-14H2;(H,3,4)(H,5,6)