4-azanyl-N-[2-[2-(2-pyrrolidin-1-ium-1-ylethoxy)phenyl]ethyl]benzenesulfonamide

Systemtic Name: 4-azanyl-N-[2-[2-(2-pyrrolidin-1-ium-1-ylethoxy)phenyl]ethyl]benzenesulfonamide Openeye Name: 4-amino-N-[2-[2-(2-pyrrolidin-1-ium-1-ylethoxy)phenyl]ethyl]benzenesulfonamide CAS Name: 4-amino-N-[2-[2-[2-(1-pyrrolidin-1-iumyl)ethoxy]phenyl]ethyl]benzenesulfonamide IUPAC Name: 4-amino-N-[2-[2-(2-pyrrolidin-1-ium-1-ylethoxy)phenyl]ethyl]benzenesulfonamide Traditional Name: 4-amino-N-[2-[2-(2-pyrrolidin-1-ium-1-ylethoxy)phenyl]ethyl]benzenesulfonamide Formula: C20H28N3O3S+ MolecularWeight: 390.51962

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCOC2=CC=CC=C2CCNS(=O)(=O)C3=CC=C(C=C3)N

Isomeric SMILES

C1CC[NH+](C1)CCOC2=CC=CC=C2CCNS(=O)(=O)C3=CC=C(C=C3)N

InChI

InChI=1S/C20H27N3O3S/c21-18-7-9-19(10-8-18)27(24,25)22-12-11-17-5-1-2-6-20(17)26-16-15-23-13-3-4-14-23/h1-2,5-10,22H,3-4,11-16,21H2/p+1