[3-[2-cyano-4-(methylsulfonylamino)phenoxy]-2-oxidanyl-propyl]-dimethyl-(2-naphthalen-2-ylethyl)azanium

Systemtic Name: [3-[2-cyano-4-(methylsulfonylamino)phenoxy]-2-oxidanyl-propyl]-dimethyl-(2-naphthalen-2-ylethyl)azanium Openeye Name: [3-[2-cyano-4-(methanesulfonamido)phenoxy]-2-hydroxy-propyl]-dimethyl-[2-(2-naphthyl)ethyl]ammonium CAS Name: [3-[2-cyano-4-(methanesulfonamido)phenoxy]-2-hydroxypropyl]-dimethyl-[2-(2-naphthalenyl)ethyl]ammonium IUPAC Name: [3-[2-cyano-4-(methanesulfonamido)phenoxy]-2-hydroxypropyl]-dimethyl-(2-naphthalen-2-ylethyl)azanium Traditional Name: [3-[2-cyano-4-(methanesulfonamido)phenoxy]-2-hydroxy-propyl]-dimethyl-[2-(2-naphthyl)ethyl]ammonium Formula: C25H30N3O4S+ MolecularWeight: 468.5884

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CCC1=CC2=CC=CC=C2C=C1)CC(COC3=C(C=C(C=C3)NS(=O)(=O)C)C#N)O

Isomeric SMILES

C[N+](C)(CCC1=CC2=CC=CC=C2C=C1)CC(COC3=C(C=C(C=C3)NS(=O)(=O)C)C#N)O

InChI

InChI=1S/C25H30N3O4S/c1-28(2,13-12-19-8-9-20-6-4-5-7-21(20)14-19)17-24(29)18-32-25-11-10-23(15-22(25)16-26)27-33(3,30)31/h4-11,14-15,24,27,29H,12-13,17-18H2,1-3H3/q+1