2-fluoranyl-5-(2,4,4-trimethyl-1,2-dihydro-3,1-benzoxazin-6-yl)benzenecarbonitrile

Systemtic Name: 2-fluoranyl-5-(2,4,4-trimethyl-1,2-dihydro-3,1-benzoxazin-6-yl)benzenecarbonitrile Openeye Name: 2-fluoro-5-(2,4,4-trimethyl-1,2-dihydro-3,1-benzoxazin-6-yl)benzonitrile CAS Name: 2-fluoro-5-(2,4,4-trimethyl-1,2-dihydro-3,1-benzoxazin-6-yl)benzonitrile IUPAC Name: 2-fluoro-5-(2,4,4-trimethyl-1,2-dihydro-3,1-benzoxazin-6-yl)benzonitrile Traditional Name: 2-fluoro-5-(2,4,4-trimethyl-1,2-dihydro-3,1-benzoxazin-6-yl)benzonitrile Formula: C18H17FN2O MolecularWeight: 296.338783

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Descriptors Computed from Structure

Canonical SMILES:

CC1NC2=C(C=C(C=C2)C3=CC(=C(C=C3)F)C#N)C(O1)(C)C

Isomeric SMILES

CC1NC2=C(C=C(C=C2)C3=CC(=C(C=C3)F)C#N)C(O1)(C)C

InChI

InChI=1S/C18H17FN2O/c1-11-21-17-7-5-13(9-15(17)18(2,3)22-11)12-4-6-16(19)14(8-12)10-20/h4-9,11,21H,1-3H3