ethyl (E)-2-cyano-3-[3-methoxy-4-[(4-methyl-2-oxidanidyl-1,2,5-oxadiazol-2-ium-3-yl)methoxy]phenyl]prop-2-enoate

Systemtic Name: ethyl (E)-2-cyano-3-[3-methoxy-4-[(4-methyl-2-oxidanidyl-1,2,5-oxadiazol-2-ium-3-yl)methoxy]phenyl]prop-2-enoate Openeye Name: ethyl (E)-2-cyano-3-[3-methoxy-4-[(4-methyl-2-oxido-1,2,5-oxadiazol-2-ium-3-yl)methoxy]phenyl]prop-2-enoate CAS Name: (E)-2-cyano-3-[3-methoxy-4-[(4-methyl-2-oxido-1,2,5-oxadiazol-2-ium-3-yl)methoxy]phenyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-2-cyano-3-[3-methoxy-4-[(4-methyl-2-oxido-1,2,5-oxadiazol-2-ium-3-yl)methoxy]phenyl]prop-2-enoate Traditional Name: (E)-2-cyano-3-[3-methoxy-4-[(4-methyl-2-oxido-furazan-2-ium-3-yl)methoxy]phenyl]acrylic acid ethyl ester Formula: C17H17N3O6 MolecularWeight: 359.33338

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=CC(=C(C=C1)OCC2=[N+](ON=C2C)[O-])OC)C#N

Isomeric SMILES

CCOC(=O)/C(=C/C1=CC(=C(C=C1)OCC2=[N+](ON=C2C)[O-])OC)/C#N

InChI

InChI=1S/C17H17N3O6/c1-4-24-17(21)13(9-18)7-12-5-6-15(16(8-12)23-3)25-10-14-11(2)19-26-20(14)22/h5-8H,4,10H2,1-3H3/b13-7+