4-methoxy-3,5-dimethyl-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-thiophen-3-yl-ethyl]benzenesulfonamide

Systemtic Name: 4-methoxy-3,5-dimethyl-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-thiophen-3-yl-ethyl]benzenesulfonamide Openeye Name: 4-methoxy-3,5-dimethyl-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-(3-thienyl)ethyl]benzenesulfonamide CAS Name: 4-methoxy-3,5-dimethyl-N-[(2S)-2-(1-pyrrolidin-1-iumyl)-2-(3-thiophenyl)ethyl]benzenesulfonamide IUPAC Name: 4-methoxy-3,5-dimethyl-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-thiophen-3-ylethyl]benzenesulfonamide Traditional Name: 4-methoxy-3,5-dimethyl-N-[(2S)-2-pyrrolidin-1-ium-1-yl-2-(3-thienyl)ethyl]benzenesulfonamide Formula: C19H27N2O3S2+ MolecularWeight: 395.55928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC)C)S(=O)(=O)NCC(C2=CSC=C2)[NH+]3CCCC3

Isomeric SMILES

CC1=CC(=CC(=C1OC)C)S(=O)(=O)NC[C@H](C2=CSC=C2)[NH+]3CCCC3

InChI

InChI=1S/C19H26N2O3S2/c1-14-10-17(11-15(2)19(14)24-3)26(22,23)20-12-18(16-6-9-25-13-16)21-7-4-5-8-21/h6,9-11,13,18,20H,4-5,7-8,12H2,1-3H3/p+1/t18-/m1/s1