4-methoxy-N-[[(3S)-1-[(5-methylthiophen-2-yl)methyl]piperidin-1-ium-3-yl]methyl]benzenesulfonamide

Systemtic Name: 4-methoxy-N-[[(3S)-1-[(5-methylthiophen-2-yl)methyl]piperidin-1-ium-3-yl]methyl]benzenesulfonamide Openeye Name: 4-methoxy-N-[[(3S)-1-[(5-methyl-2-thienyl)methyl]piperidin-1-ium-3-yl]methyl]benzenesulfonamide CAS Name: 4-methoxy-N-[[(3S)-1-[(5-methyl-2-thiophenyl)methyl]-3-piperidin-1-iumyl]methyl]benzenesulfonamide IUPAC Name: 4-methoxy-N-[[(3S)-1-[(5-methylthiophen-2-yl)methyl]piperidin-1-ium-3-yl]methyl]benzenesulfonamide Traditional Name: 4-methoxy-N-[[(3S)-1-[(5-methyl-2-thienyl)methyl]piperidin-1-ium-3-yl]methyl]benzenesulfonamide Formula: C19H27N2O3S2+ MolecularWeight: 395.55928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C[NH+]2CCCC(C2)CNS(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC=C(S1)C[NH+]2CCC[C@@H](C2)CNS(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C19H26N2O3S2/c1-15-5-8-18(25-15)14-21-11-3-4-16(13-21)12-20-26(22,23)19-9-6-17(24-2)7-10-19/h5-10,16,20H,3-4,11-14H2,1-2H3/p+1/t16-/m1/s1