methyl (E)-2-azanyl-2-methyl-7-(3-methyl-5-oxidanylidene-2H-1,2,4-oxadiazol-4-ium-4-yl)hept-4-enoate

Systemtic Name: methyl (E)-2-azanyl-2-methyl-7-(3-methyl-5-oxidanylidene-2H-1,2,4-oxadiazol-4-ium-4-yl)hept-4-enoate Openeye Name: methyl (E)-2-amino-2-methyl-7-(3-methyl-5-oxo-2H-1,2,4-oxadiazol-4-ium-4-yl)hept-4-enoate CAS Name: (E)-2-amino-2-methyl-7-(3-methyl-5-oxo-2H-1,2,4-oxadiazol-4-ium-4-yl)-4-heptenoic acid methyl ester IUPAC Name: methyl (E)-2-amino-2-methyl-7-(3-methyl-5-oxo-2H-1,2,4-oxadiazol-4-ium-4-yl)hept-4-enoate Traditional Name: (E)-2-amino-7-(5-keto-3-methyl-2H-1,2,4-oxadiazol-4-ium-4-yl)-2-methyl-hept-4-enoic acid methyl ester Formula: C12H20N3O4+ MolecularWeight: 270.3049

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C(=O)ON1)CCC=CCC(C)(C(=O)OC)N

Isomeric SMILES

CC1=[N+](C(=O)ON1)CC/C=C/CC(C)(C(=O)OC)N

InChI

InChI=1S/C12H19N3O4/c1-9-14-19-11(17)15(9)8-6-4-5-7-12(2,13)10(16)18-3/h4-5H,6-8,13H2,1-3H3/p+1/b5-4+