2-[4-[(2R)-oxolan-2-yl]carbonylpiperazin-1-ium-1-yl]-N-(3-piperidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-[4-[(2R)-oxolan-2-yl]carbonylpiperazin-1-ium-1-yl]-N-(3-piperidin-1-ylsulfonylphenyl)ethanamide Openeye Name: N-[3-(1-piperidylsulfonyl)phenyl]-2-[4-[(2R)-tetrahydrofuran-2-carbonyl]piperazin-1-ium-1-yl]acetamide CAS Name: 2-[4-[oxo-[(2R)-2-oxolanyl]methyl]-1-piperazin-1-iumyl]-N-[3-(1-piperidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[4-[(2R)-oxolane-2-carbonyl]piperazin-1-ium-1-yl]-N-(3-piperidin-1-ylsulfonylphenyl)acetamide Traditional Name: N-(3-piperidinosulfonylphenyl)-2-[4-[(2R)-tetrahydrofuran-2-carbonyl]piperazin-1-ium-1-yl]acetamide Formula: C22H33N4O5S+ MolecularWeight: 465.58622

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C[NH+]3CCN(CC3)C(=O)C4CCCO4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C[NH+]3CCN(CC3)C(=O)[C@H]4CCCO4

InChI

InChI=1S/C22H32N4O5S/c27-21(17-24-11-13-25(14-12-24)22(28)20-8-5-15-31-20)23-18-6-4-7-19(16-18)32(29,30)26-9-2-1-3-10-26/h4,6-7,16,20H,1-3,5,8-15,17H2,(H,23,27)/p+1/t20-/m1/s1