7-fluoranyl-6-isothiocyanato-4-prop-2-ynyl-4H-1,2-benzoxazin-3-one

Systemtic Name: 7-fluoranyl-6-isothiocyanato-4-prop-2-ynyl-4H-1,2-benzoxazin-3-one Openeye Name: 7-fluoro-6-isothiocyanato-4-prop-2-ynyl-4H-1,2-benzoxazin-3-one CAS Name: 7-fluoro-6-isothiocyanato-4-prop-2-ynyl-4H-1,2-benzoxazin-3-one IUPAC Name: 7-fluoro-6-isothiocyanato-4-prop-2-ynyl-4H-1,2-benzoxazin-3-one Traditional Name: 7-fluoro-6-isothiocyanato-4-propargyl-4H-1,2-benzoxazin-3-one Formula: C12H7FN2O2S MolecularWeight: 262.259583

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Descriptors Computed from Structure

Canonical SMILES:

C#CCC1C2=CC(=C(C=C2ONC1=O)F)N=C=S

Isomeric SMILES

C#CCC1C2=CC(=C(C=C2ONC1=O)F)N=C=S

InChI

InChI=1S/C12H7FN2O2S/c1-2-3-7-8-4-10(14-6-18)9(13)5-11(8)17-15-12(7)16/h1,4-5,7H,3H2,(H,15,16)