[4-[5-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-3-yl]phenyl]-dimethyl-sulfo-azanium

Systemtic Name: [4-[5-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-3-yl]phenyl]-dimethyl-sulfo-azanium Openeye Name: [4-[5-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-3-yl]phenyl]-dimethyl-sulfo-ammonium CAS Name: [4-[5-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-3-yl]phenyl]-dimethyl-sulfoammonium IUPAC Name: [4-[5-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-3-yl]phenyl]-dimethyl-sulfoazanium Traditional Name: [4-[5-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-3-yl]phenyl]-dimethyl-sulfo-ammonium Formula: C18H20N3O6S+ MolecularWeight: 406.4329

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C1=CC=C(C=C1)C2=NOC(=N2)C3=CC(=C(C=C3)OC)OC)S(=O)(=O)O

Isomeric SMILES

C[N+](C)(C1=CC=C(C=C1)C2=NOC(=N2)C3=CC(=C(C=C3)OC)OC)S(=O)(=O)O

InChI

InChI=1S/C18H19N3O6S/c1-21(2,28(22,23)24)14-8-5-12(6-9-14)17-19-18(27-20-17)13-7-10-15(25-3)16(11-13)26-4/h5-11H,1-4H3/p+1