(Z)-2-methyl-3-thiocyanato-but-2-enoate

Systemtic Name: (Z)-2-methyl-3-thiocyanato-but-2-enoate Openeye Name: (Z)-2-methyl-3-thiocyanato-but-2-enoate CAS Name: (Z)-2-methyl-3-thiocyanato-2-butenoate IUPAC Name: (Z)-2-methyl-3-thiocyanatobut-2-enoate Traditional Name: (Z)-2-methyl-3-thiocyanato-but-2-enoate Formula: C6H6NO2S- MolecularWeight: 156.18234

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C)SC#N)C(=O)[O-]

Isomeric SMILES

C/C(=C(\C)/SC#N)/C(=O)[O-]

InChI

InChI=1S/C6H7NO2S/c1-4(6(8)9)5(2)10-3-7/h1-2H3,(H,8,9)/p-1/b5-4-