(2R)-1-butyl-N-(2,6-dimethyl-3-piperidin-1-ylsulfonyl-phenyl)piperidin-1-ium-2-carboxamide

Systemtic Name: (2R)-1-butyl-N-(2,6-dimethyl-3-piperidin-1-ylsulfonyl-phenyl)piperidin-1-ium-2-carboxamide Openeye Name: (2R)-1-butyl-N-[2,6-dimethyl-3-(1-piperidylsulfonyl)phenyl]piperidin-1-ium-2-carboxamide CAS Name: (2R)-1-butyl-N-[2,6-dimethyl-3-(1-piperidinylsulfonyl)phenyl]-2-piperidin-1-iumcarboxamide IUPAC Name: (2R)-1-butyl-N-(2,6-dimethyl-3-piperidin-1-ylsulfonylphenyl)piperidin-1-ium-2-carboxamide Traditional Name: (2R)-1-butyl-N-(2,6-dimethyl-3-piperidinosulfonyl-phenyl)piperidin-1-ium-2-carboxamide Formula: C23H38N3O3S+ MolecularWeight: 436.63112

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+]1CCCCC1C(=O)NC2=C(C=CC(=C2C)S(=O)(=O)N3CCCCC3)C

Isomeric SMILES

CCCC[NH+]1CCCC[C@@H]1C(=O)NC2=C(C=CC(=C2C)S(=O)(=O)N3CCCCC3)C

InChI

InChI=1S/C23H37N3O3S/c1-4-5-14-25-15-10-7-11-20(25)23(27)24-22-18(2)12-13-21(19(22)3)30(28,29)26-16-8-6-9-17-26/h12-13,20H,4-11,14-17H2,1-3H3,(H,24,27)/p+1/t20-/m1/s1