1-isocyanato-3-phenyl-propan-1-one

Systemtic Name: 1-isocyanato-3-phenyl-propan-1-one Openeye Name: 3-phenylpropanoyl isocyanate CAS Name: 1-isocyanato-3-phenyl-1-propanone IUPAC Name: 3-phenylpropanoyl isocyanate Traditional Name: 1-isocyanato-3-phenyl-propan-1-one Formula: C10H9NO2 MolecularWeight: 175.18396

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H9NO2/c12-8-11-10(13)7-6-9-4-2-1-3-5-9/h1-5H,6-7H2