2-(3,5-dimethyl-4-pyrrolidin-1-ylsulfonyl-phenoxy)ethylazanium

Systemtic Name: 2-(3,5-dimethyl-4-pyrrolidin-1-ylsulfonyl-phenoxy)ethylazanium Openeye Name: 2-(3,5-dimethyl-4-pyrrolidin-1-ylsulfonyl-phenoxy)ethylammonium CAS Name: 2-[3,5-dimethyl-4-(1-pyrrolidinylsulfonyl)phenoxy]ethylammonium IUPAC Name: 2-(3,5-dimethyl-4-pyrrolidin-1-ylsulfonylphenoxy)ethylazanium Traditional Name: 2-(3,5-dimethyl-4-pyrrolidinosulfonyl-phenoxy)ethylammonium Formula: C14H23N2O3S+ MolecularWeight: 299.40902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1S(=O)(=O)N2CCCC2)C)OCC[NH3+]

Isomeric SMILES

CC1=CC(=CC(=C1S(=O)(=O)N2CCCC2)C)OCC[NH3+]

InChI

InChI=1S/C14H22N2O3S/c1-11-9-13(19-8-5-15)10-12(2)14(11)20(17,18)16-6-3-4-7-16/h9-10H,3-8,15H2,1-2H3/p+1