3-ethanoyl-N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ium-1-yl-ethyl]benzenesulfonamide

Systemtic Name: 3-ethanoyl-N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ium-1-yl-ethyl]benzenesulfonamide Openeye Name: 3-acetyl-N-[(2R)-2-(2-furyl)-2-piperidin-1-ium-1-yl-ethyl]benzenesulfonamide CAS Name: 3-acetyl-N-[(2R)-2-(2-furanyl)-2-(1-piperidin-1-iumyl)ethyl]benzenesulfonamide IUPAC Name: 3-acetyl-N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ium-1-ylethyl]benzenesulfonamide Traditional Name: 3-acetyl-N-[(2R)-2-(2-furyl)-2-piperidin-1-ium-1-yl-ethyl]benzenesulfonamide Formula: C19H25N2O4S+ MolecularWeight: 377.4778

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)S(=O)(=O)NCC(C2=CC=CO2)[NH+]3CCCCC3

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)S(=O)(=O)NC[C@H](C2=CC=CO2)[NH+]3CCCCC3

InChI

InChI=1S/C19H24N2O4S/c1-15(22)16-7-5-8-17(13-16)26(23,24)20-14-18(19-9-6-12-25-19)21-10-3-2-4-11-21/h5-9,12-13,18,20H,2-4,10-11,14H2,1H3/p+1/t18-/m1/s1