N-[1-[3-(4-cyclopropylcarbonylphenoxy)propyl]pyrrolidin-1-ium-1-yl]propane-2-sulfonamide

Systemtic Name: N-[1-[3-(4-cyclopropylcarbonylphenoxy)propyl]pyrrolidin-1-ium-1-yl]propane-2-sulfonamide Openeye Name: N-[1-[3-[4-(cyclopropanecarbonyl)phenoxy]propyl]pyrrolidin-1-ium-1-yl]propane-2-sulfonamide CAS Name: N-[1-[3-[4-[cyclopropyl(oxo)methyl]phenoxy]propyl]-1-pyrrolidin-1-iumyl]-2-propanesulfonamide IUPAC Name: N-[1-[3-[4-(cyclopropanecarbonyl)phenoxy]propyl]pyrrolidin-1-ium-1-yl]propane-2-sulfonamide Traditional Name: N-[1-[3-[4-(cyclopropanecarbonyl)phenoxy]propyl]pyrrolidin-1-ium-1-yl]propane-2-sulfonamide Formula: C20H31N2O4S+ MolecularWeight: 395.53614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)N[N+]1(CCCC1)CCCOC2=CC=C(C=C2)C(=O)C3CC3

Isomeric SMILES

CC(C)S(=O)(=O)N[N+]1(CCCC1)CCCOC2=CC=C(C=C2)C(=O)C3CC3

InChI

InChI=1S/C20H31N2O4S/c1-16(2)27(24,25)21-22(12-3-4-13-22)14-5-15-26-19-10-8-18(9-11-19)20(23)17-6-7-17/h8-11,16-17,21H,3-7,12-15H2,1-2H3/q+1