ethanedioic acid; 2-(furan-2-ylmethylamino)-N-(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)ethanamide

Systemtic Name: ethanedioic acid; 2-(furan-2-ylmethylamino)-N-(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)ethanamide Openeye Name: 2-(2-furylmethylamino)-N-[2-methoxy-5-(1-piperidylsulfonyl)phenyl]acetamide; oxalic acid CAS Name: 2-(2-furanylmethylamino)-N-[2-methoxy-5-(1-piperidinylsulfonyl)phenyl]acetamide; oxalic acid IUPAC Name: 2-(furan-2-ylmethylamino)-N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)acetamide; oxalic acid Traditional Name: 2-(2-furfurylamino)-N-(2-methoxy-5-piperidinosulfonyl-phenyl)acetamide; oxalic acid Formula: C21H27N3O9S MolecularWeight: 497.51878

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)CNCC3=CC=CO3.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)CNCC3=CC=CO3.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H25N3O5S.C2H2O4/c1-26-18-8-7-16(28(24,25)22-9-3-2-4-10-22)12-17(18)21-19(23)14-20-13-15-6-5-11-27-15;3-1(4)2(5)6/h5-8,11-12,20H,2-4,9-10,13-14H2,1H3,(H,21,23);(H,3,4)(H,5,6)