3-(2-methyl-4-pyrrolidin-1-ylsulfonyl-phenoxy)propylazanium

Systemtic Name: 3-(2-methyl-4-pyrrolidin-1-ylsulfonyl-phenoxy)propylazanium Openeye Name: 3-(2-methyl-4-pyrrolidin-1-ylsulfonyl-phenoxy)propylammonium CAS Name: 3-[2-methyl-4-(1-pyrrolidinylsulfonyl)phenoxy]propylammonium IUPAC Name: 3-(2-methyl-4-pyrrolidin-1-ylsulfonylphenoxy)propylazanium Traditional Name: 3-(2-methyl-4-pyrrolidinosulfonyl-phenoxy)propylammonium Formula: C14H23N2O3S+ MolecularWeight: 299.40902

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)N2CCCC2)OCCC[NH3+]

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)N2CCCC2)OCCC[NH3+]

InChI

InChI=1S/C14H22N2O3S/c1-12-11-13(5-6-14(12)19-10-4-7-15)20(17,18)16-8-2-3-9-16/h5-6,11H,2-4,7-10,15H2,1H3/p+1