N-[[1-(furan-2-ylmethyl)piperidin-1-ium-4-yl]methyl]-4-methoxy-3-methyl-benzenesulfonamide

Systemtic Name: N-[[1-(furan-2-ylmethyl)piperidin-1-ium-4-yl]methyl]-4-methoxy-3-methyl-benzenesulfonamide Openeye Name: N-[[1-(2-furylmethyl)piperidin-1-ium-4-yl]methyl]-4-methoxy-3-methyl-benzenesulfonamide CAS Name: N-[[1-(2-furanylmethyl)-4-piperidin-1-iumyl]methyl]-4-methoxy-3-methylbenzenesulfonamide IUPAC Name: N-[[1-(furan-2-ylmethyl)piperidin-1-ium-4-yl]methyl]-4-methoxy-3-methylbenzenesulfonamide Traditional Name: N-[[1-(2-furfuryl)piperidin-1-ium-4-yl]methyl]-4-methoxy-3-methyl-benzenesulfonamide Formula: C19H27N2O4S+ MolecularWeight: 379.49368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)NCC2CC[NH+](CC2)CC3=CC=CO3)OC

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)NCC2CC[NH+](CC2)CC3=CC=CO3)OC

InChI

InChI=1S/C19H26N2O4S/c1-15-12-18(5-6-19(15)24-2)26(22,23)20-13-16-7-9-21(10-8-16)14-17-4-3-11-25-17/h3-6,11-12,16,20H,7-10,13-14H2,1-2H3/p+1