[2-chloranylethanoyl-(2,6-dimethylphenyl)amino]methyl thiocyanate

Systemtic Name: [2-chloranylethanoyl-(2,6-dimethylphenyl)amino]methyl thiocyanate Openeye Name: (N-(2-chloroacetyl)-2,6-dimethyl-anilino)methyl thiocyanate CAS Name: thiocyanic acid (N-(2-chloro-1-oxoethyl)-2,6-dimethylanilino)methyl ester IUPAC Name: (N-(2-chloroacetyl)-2,6-dimethylanilino)methyl thiocyanate Traditional Name: thiocyanic acid (N-(2-chloroacetyl)-2,6-dimethyl-anilino)methyl ester Formula: C12H13ClN2OS MolecularWeight: 268.76242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N(CSC#N)C(=O)CCl

Isomeric SMILES

CC1=C(C(=CC=C1)C)N(CSC#N)C(=O)CCl

InChI

InChI=1S/C12H13ClN2OS/c1-9-4-3-5-10(2)12(9)15(8-17-7-14)11(16)6-13/h3-5H,6,8H2,1-2H3