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

Systemtic Name: 4-azanyl-N-[[4-(2-pyrrolidin-1-ium-1-ylethoxy)phenyl]methyl]benzenesulfonamide Openeye Name: 4-amino-N-[[4-(2-pyrrolidin-1-ium-1-ylethoxy)phenyl]methyl]benzenesulfonamide CAS Name: 4-amino-N-[[4-[2-(1-pyrrolidin-1-iumyl)ethoxy]phenyl]methyl]benzenesulfonamide IUPAC Name: 4-amino-N-[[4-(2-pyrrolidin-1-ium-1-ylethoxy)phenyl]methyl]benzenesulfonamide Traditional Name: 4-amino-N-[4-(2-pyrrolidin-1-ium-1-ylethoxy)benzyl]benzenesulfonamide Formula: C19H26N3O3S+ MolecularWeight: 376.49304

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCOC2=CC=C(C=C2)CNS(=O)(=O)C3=CC=C(C=C3)N

Isomeric SMILES

C1CC[NH+](C1)CCOC2=CC=C(C=C2)CNS(=O)(=O)C3=CC=C(C=C3)N

InChI

InChI=1S/C19H25N3O3S/c20-17-5-9-19(10-6-17)26(23,24)21-15-16-3-7-18(8-4-16)25-14-13-22-11-1-2-12-22/h3-10,21H,1-2,11-15,20H2/p+1