dimethyl (E)-2-thiocyanatobut-2-enedioate

Systemtic Name: dimethyl (E)-2-thiocyanatobut-2-enedioate Openeye Name: dimethyl (E)-2-thiocyanatobut-2-enedioate CAS Name: (E)-2-thiocyanato-2-butenedioic acid dimethyl ester IUPAC Name: dimethyl (E)-2-thiocyanatobut-2-enedioate Traditional Name: (E)-2-thiocyanatobut-2-enedioic acid dimethyl ester Formula: C7H7NO4S MolecularWeight: 201.19978

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=C(C(=O)OC)SC#N

Isomeric SMILES

COC(=O)/C=C(\C(=O)OC)/SC#N

InChI

InChI=1S/C7H7NO4S/c1-11-6(9)3-5(13-4-8)7(10)12-2/h3H,1-2H3/b5-3+