(phenylmethyl) 2-chloranyl-4-fluoranyl-5-isocyanato-benzoate

Systemtic Name: (phenylmethyl) 2-chloranyl-4-fluoranyl-5-isocyanato-benzoate Openeye Name: benzyl 2-chloro-4-fluoro-5-isocyanato-benzoate CAS Name: 2-chloro-4-fluoro-5-isocyanatobenzoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-chloro-4-fluoro-5-isocyanatobenzoate Traditional Name: 2-chloro-4-fluoro-5-isocyanato-benzoic acid benzyl ester Formula: C15H9ClFNO3 MolecularWeight: 305.688263

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C2=CC(=C(C=C2Cl)F)N=C=O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C2=CC(=C(C=C2Cl)F)N=C=O

InChI

InChI=1S/C15H9ClFNO3/c16-12-7-13(17)14(18-9-19)6-11(12)15(20)21-8-10-4-2-1-3-5-10/h1-7H,8H2