N-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]-2-(oxolan-2-ylmethylamino)ethanamide; ethanedioic acid

Systemtic Name: N-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]-2-(oxolan-2-ylmethylamino)ethanamide; ethanedioic acid Openeye Name: N-[4-[(2,6-dimethyl-1-piperidyl)sulfonyl]phenyl]-2-(tetrahydrofuran-2-ylmethylamino)acetamide; oxalic acid CAS Name: N-[4-[(2,6-dimethyl-1-piperidinyl)sulfonyl]phenyl]-2-(2-oxolanylmethylamino)acetamide; oxalic acid IUPAC Name: N-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]-2-(oxolan-2-ylmethylamino)acetamide; oxalic acid Traditional Name: N-[4-(2,6-dimethylpiperidino)sulfonylphenyl]-2-(tetrahydrofurfurylamino)acetamide; oxalic acid Formula: C22H33N3O8S MolecularWeight: 499.57772

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1S(=O)(=O)C2=CC=C(C=C2)NC(=O)CNCC3CCCO3)C.C(=O)(C(=O)O)O

Isomeric SMILES

CC1CCCC(N1S(=O)(=O)C2=CC=C(C=C2)NC(=O)CNCC3CCCO3)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H31N3O4S.C2H2O4/c1-15-5-3-6-16(2)23(15)28(25,26)19-10-8-17(9-11-19)22-20(24)14-21-13-18-7-4-12-27-18;3-1(4)2(5)6/h8-11,15-16,18,21H,3-7,12-14H2,1-2H3,(H,22,24);(H,3,4)(H,5,6)