dimethyl (E)-2-(1,2,3-thiadiazol-2-ium-2-ylamino)but-2-enedioate

Systemtic Name: dimethyl (E)-2-(1,2,3-thiadiazol-2-ium-2-ylamino)but-2-enedioate Openeye Name: dimethyl (E)-2-(thiadiazol-2-ium-2-ylamino)but-2-enedioate CAS Name: (E)-2-(2-thiadiazol-2-iumylamino)-2-butenedioic acid dimethyl ester IUPAC Name: dimethyl (E)-2-(thiadiazol-2-ium-2-ylamino)but-2-enedioate Traditional Name: (E)-2-(thiadiazol-2-ium-2-ylamino)but-2-enedioic acid dimethyl ester Formula: C8H10N3O4S+ MolecularWeight: 244.2477

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=C(C(=O)OC)N[N+]1=NC=CS1

Isomeric SMILES

COC(=O)/C=C(\C(=O)OC)/N[N+]1=NC=CS1

InChI

InChI=1S/C8H9N3O4S/c1-14-7(12)5-6(8(13)15-2)10-11-9-3-4-16-11/h3-5H,1-2H3/p+1