3-[(4-ethoxy-3-methoxy-phenyl)methyl]-2H-1,2,3-oxadiazol-3-ium-5-one

Systemtic Name: 3-[(4-ethoxy-3-methoxy-phenyl)methyl]-2H-1,2,3-oxadiazol-3-ium-5-one Openeye Name: 3-[(4-ethoxy-3-methoxy-phenyl)methyl]-2H-oxadiazol-3-ium-5-one CAS Name: 3-[(4-ethoxy-3-methoxyphenyl)methyl]-2H-oxadiazol-3-ium-5-one IUPAC Name: 3-[(4-ethoxy-3-methoxyphenyl)methyl]-2H-oxadiazol-3-ium-5-one Traditional Name: 3-(4-ethoxy-3-methoxy-benzyl)-2H-oxadiazol-3-ium-5-one Formula: C12H15N2O4+ MolecularWeight: 251.2585

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C[N+]2=CC(=O)ON2)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C[N+]2=CC(=O)ON2)OC

InChI

InChI=1S/C12H14N2O4/c1-3-17-10-5-4-9(6-11(10)16-2)7-14-8-12(15)18-13-14/h4-6,8H,3,7H2,1-2H3/p+1