N-[1-[3-(4-cyclopropylcarbonylphenoxy)propyl]pyrrolidin-1-ium-1-yl]-4-propan-2-yl-benzenesulfonamide

Systemtic Name: N-[1-[3-(4-cyclopropylcarbonylphenoxy)propyl]pyrrolidin-1-ium-1-yl]-4-propan-2-yl-benzenesulfonamide Openeye Name: N-[1-[3-[4-(cyclopropanecarbonyl)phenoxy]propyl]pyrrolidin-1-ium-1-yl]-4-isopropyl-benzenesulfonamide CAS Name: N-[1-[3-[4-[cyclopropyl(oxo)methyl]phenoxy]propyl]-1-pyrrolidin-1-iumyl]-4-propan-2-ylbenzenesulfonamide IUPAC Name: N-[1-[3-[4-(cyclopropanecarbonyl)phenoxy]propyl]pyrrolidin-1-ium-1-yl]-4-propan-2-ylbenzenesulfonamide Traditional Name: N-[1-[3-[4-(cyclopropanecarbonyl)phenoxy]propyl]pyrrolidin-1-ium-1-yl]-4-isopropyl-benzenesulfonamide Formula: C26H35N2O4S+ MolecularWeight: 471.6321

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)N[N+]2(CCCC2)CCCOC3=CC=C(C=C3)C(=O)C4CC4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)N[N+]2(CCCC2)CCCOC3=CC=C(C=C3)C(=O)C4CC4

InChI

InChI=1S/C26H35N2O4S/c1-20(2)21-10-14-25(15-11-21)33(30,31)27-28(16-3-4-17-28)18-5-19-32-24-12-8-23(9-13-24)26(29)22-6-7-22/h8-15,20,22,27H,3-7,16-19H2,1-2H3/q+1