(5-benzamido-2-chloranyl-4-ethanoyl-phenyl) thiocyanate

Systemtic Name: (5-benzamido-2-chloranyl-4-ethanoyl-phenyl) thiocyanate Openeye Name: (4-acetyl-5-benzamido-2-chloro-phenyl) thiocyanate CAS Name: thiocyanic acid (4-acetyl-5-benzamido-2-chlorophenyl) ester IUPAC Name: (4-acetyl-5-benzamido-2-chlorophenyl) thiocyanate Traditional Name: thiocyanic acid (4-acetyl-5-benzamido-2-chloro-phenyl) ester Formula: C16H11ClN2O2S MolecularWeight: 330.78874

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1NC(=O)C2=CC=CC=C2)SC#N)Cl

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1NC(=O)C2=CC=CC=C2)SC#N)Cl

InChI

InChI=1S/C16H11ClN2O2S/c1-10(20)12-7-13(17)15(22-9-18)8-14(12)19-16(21)11-5-3-2-4-6-11/h2-8H,1H3,(H,19,21)