(3-benzamido-4-ethanoyl-phenyl) thiocyanate

Systemtic Name: (3-benzamido-4-ethanoyl-phenyl) thiocyanate Openeye Name: (4-acetyl-3-benzamido-phenyl) thiocyanate CAS Name: thiocyanic acid (4-acetyl-3-benzamidophenyl) ester IUPAC Name: (4-acetyl-3-benzamidophenyl) thiocyanate Traditional Name: thiocyanic acid (4-acetyl-3-benzamido-phenyl) ester Formula: C16H12N2O2S MolecularWeight: 296.34368

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=C(C=C1)SC#N)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CC(=O)C1=C(C=C(C=C1)SC#N)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H12N2O2S/c1-11(19)14-8-7-13(21-10-17)9-15(14)18-16(20)12-5-3-2-4-6-12/h2-9H,1H3,(H,18,20)