1-(4-propan-2-ylphenyl)sulfonyl-N-(1-propan-2-ylpiperidin-1-ium-4-yl)piperidine-4-carboxamide

Systemtic Name: 1-(4-propan-2-ylphenyl)sulfonyl-N-(1-propan-2-ylpiperidin-1-ium-4-yl)piperidine-4-carboxamide Openeye Name: 1-(4-isopropylphenyl)sulfonyl-N-(1-isopropylpiperidin-1-ium-4-yl)piperidine-4-carboxamide CAS Name: 1-(4-propan-2-ylphenyl)sulfonyl-N-(1-propan-2-yl-4-piperidin-1-iumyl)-4-piperidinecarboxamide IUPAC Name: 1-(4-propan-2-ylphenyl)sulfonyl-N-(1-propan-2-ylpiperidin-1-ium-4-yl)piperidine-4-carboxamide Traditional Name: N-(1-isopropylpiperidin-1-ium-4-yl)-1-p-cumenylsulfonyl-isonipecotamide Formula: C23H38N3O3S+ MolecularWeight: 436.63112

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3CC[NH+](CC3)C(C)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3CC[NH+](CC3)C(C)C

InChI

InChI=1S/C23H37N3O3S/c1-17(2)19-5-7-22(8-6-19)30(28,29)26-15-9-20(10-16-26)23(27)24-21-11-13-25(14-12-21)18(3)4/h5-8,17-18,20-21H,9-16H2,1-4H3,(H,24,27)/p+1