N-[3-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]propyl]naphthalene-2-sulfonamide

Systemtic Name: N-[3-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]propyl]naphthalene-2-sulfonamide Openeye Name: N-[3-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]propyl]naphthalene-2-sulfonamide CAS Name: N-[3-[(3R,5R)-3,5-dimethyl-1-piperidin-1-iumyl]propyl]-2-naphthalenesulfonamide IUPAC Name: N-[3-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]propyl]naphthalene-2-sulfonamide Traditional Name: N-[3-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]propyl]naphthalene-2-sulfonamide Formula: C20H29N2O2S+ MolecularWeight: 361.52146

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C[NH+](C1)CCCNS(=O)(=O)C2=CC3=CC=CC=C3C=C2)C

Isomeric SMILES

C[C@@H]1C[C@H](C[NH+](C1)CCCNS(=O)(=O)C2=CC3=CC=CC=C3C=C2)C

InChI

InChI=1S/C20H28N2O2S/c1-16-12-17(2)15-22(14-16)11-5-10-21-25(23,24)20-9-8-18-6-3-4-7-19(18)13-20/h3-4,6-9,13,16-17,21H,5,10-12,14-15H2,1-2H3/p+1/t16-,17-/m1/s1