2-[4-[(4-cyclohexylphenyl)sulfonylamino]piperidin-1-ium-1-yl]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[4-[(4-cyclohexylphenyl)sulfonylamino]piperidin-1-ium-1-yl]-N-propan-2-yl-ethanamide Openeye Name: 2-[4-[(4-cyclohexylphenyl)sulfonylamino]piperidin-1-ium-1-yl]-N-isopropyl-acetamide CAS Name: 2-[4-[(4-cyclohexylphenyl)sulfonylamino]-1-piperidin-1-iumyl]-N-propan-2-ylacetamide IUPAC Name: 2-[4-[(4-cyclohexylphenyl)sulfonylamino]piperidin-1-ium-1-yl]-N-propan-2-ylacetamide Traditional Name: 2-[4-[(4-cyclohexylphenyl)sulfonylamino]piperidin-1-ium-1-yl]-N-isopropyl-acetamide Formula: C22H36N3O3S+ MolecularWeight: 422.60454

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C[NH+]1CCC(CC1)NS(=O)(=O)C2=CC=C(C=C2)C3CCCCC3

Isomeric SMILES

CC(C)NC(=O)C[NH+]1CCC(CC1)NS(=O)(=O)C2=CC=C(C=C2)C3CCCCC3

InChI

InChI=1S/C22H35N3O3S/c1-17(2)23-22(26)16-25-14-12-20(13-15-25)24-29(27,28)21-10-8-19(9-11-21)18-6-4-3-5-7-18/h8-11,17-18,20,24H,3-7,12-16H2,1-2H3,(H,23,26)/p+1