ethanedioic acid; N-[4-[4-(furan-2-ylmethyl)piperazin-1-yl]sulfonylphenyl]ethanamide

Systemtic Name: ethanedioic acid; N-[4-[4-(furan-2-ylmethyl)piperazin-1-yl]sulfonylphenyl]ethanamide Openeye Name: N-[4-[4-(2-furylmethyl)piperazin-1-yl]sulfonylphenyl]acetamide; oxalic acid CAS Name: N-[4-[[4-(2-furanylmethyl)-1-piperazinyl]sulfonyl]phenyl]acetamide; oxalic acid IUPAC Name: N-[4-[4-(furan-2-ylmethyl)piperazin-1-yl]sulfonylphenyl]acetamide; oxalic acid Traditional Name: N-[4-[4-(2-furfuryl)piperazino]sulfonylphenyl]acetamide; oxalic acid Formula: C19H23N3O8S MolecularWeight: 453.46622

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=CO3.C(=O)(C(=O)O)O

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=CO3.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H21N3O4S.C2H2O4/c1-14(21)18-15-4-6-17(7-5-15)25(22,23)20-10-8-19(9-11-20)13-16-3-2-12-24-16;3-1(4)2(5)6/h2-7,12H,8-11,13H2,1H3,(H,18,21);(H,3,4)(H,5,6)