7-fluoranyl-6-isothiocyanato-4-(2-methylbutyl)-1,4-benzoxazin-3-one

Systemtic Name: 7-fluoranyl-6-isothiocyanato-4-(2-methylbutyl)-1,4-benzoxazin-3-one Openeye Name: 7-fluoro-6-isothiocyanato-4-(2-methylbutyl)-1,4-benzoxazin-3-one CAS Name: 7-fluoro-6-isothiocyanato-4-(2-methylbutyl)-1,4-benzoxazin-3-one IUPAC Name: 7-fluoro-6-isothiocyanato-4-(2-methylbutyl)-1,4-benzoxazin-3-one Traditional Name: 7-fluoro-6-isothiocyanato-4-(2-methylbutyl)-1,4-benzoxazin-3-one Formula: C14H15FN2O2S MolecularWeight: 294.344503

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CN1C(=O)COC2=C1C=C(C(=C2)F)N=C=S

Isomeric SMILES

CCC(C)CN1C(=O)COC2=C1C=C(C(=C2)F)N=C=S

InChI

InChI=1S/C14H15FN2O2S/c1-3-9(2)6-17-12-5-11(16-8-20)10(15)4-13(12)19-7-14(17)18/h4-5,9H,3,6-7H2,1-2H3