methyl (E)-7-[4-methyl-3,5-bis(oxidanylidene)-1,2,4-triazolidin-1-yl]hept-5-enoate

Systemtic Name: methyl (E)-7-[4-methyl-3,5-bis(oxidanylidene)-1,2,4-triazolidin-1-yl]hept-5-enoate Openeye Name: methyl (E)-7-(4-methyl-3,5-dioxo-1,2,4-triazolidin-1-yl)hept-5-enoate CAS Name: (E)-7-(4-methyl-3,5-dioxo-1,2,4-triazolidin-1-yl)-5-heptenoic acid methyl ester IUPAC Name: methyl (E)-7-(4-methyl-3,5-dioxo-1,2,4-triazolidin-1-yl)hept-5-enoate Traditional Name: (E)-7-(3,5-diketo-4-methyl-1,2,4-triazolidin-1-yl)hept-5-enoic acid methyl ester Formula: C11H17N3O4 MolecularWeight: 255.27038

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)NN(C1=O)CC=CCCCC(=O)OC

Isomeric SMILES

CN1C(=O)NN(C1=O)C/C=C/CCCC(=O)OC

InChI

InChI=1S/C11H17N3O4/c1-13-10(16)12-14(11(13)17)8-6-4-3-5-7-9(15)18-2/h4,6H,3,5,7-8H2,1-2H3,(H,12,16)/b6-4+