1-(3-ethanoyl-5-isocyanato-phenyl)ethanone

Systemtic Name: 1-(3-ethanoyl-5-isocyanato-phenyl)ethanone Openeye Name: 1-(3-acetyl-5-isocyanato-phenyl)ethanone CAS Name: 1-(3-acetyl-5-isocyanatophenyl)ethanone IUPAC Name: 1-(3-acetyl-5-isocyanatophenyl)ethanone Traditional Name: 1-(3-acetyl-5-isocyanato-phenyl)ethanone Formula: C11H9NO3 MolecularWeight: 203.19406

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC(=C1)N=C=O)C(=O)C

Isomeric SMILES

CC(=O)C1=CC(=CC(=C1)N=C=O)C(=O)C

InChI

InChI=1S/C11H9NO3/c1-7(14)9-3-10(8(2)15)5-11(4-9)12-6-13/h3-5H,1-2H3