2-(7-fluoranyl-2-propan-2-yl-3-sulfanylidene-1,4-benzoxazin-4-yl)ethanoic acid

Systemtic Name: 2-(7-fluoranyl-2-propan-2-yl-3-sulfanylidene-1,4-benzoxazin-4-yl)ethanoic acid Openeye Name: 2-(7-fluoro-2-isopropyl-3-thioxo-1,4-benzoxazin-4-yl)acetic acid CAS Name: 2-(7-fluoro-2-propan-2-yl-3-sulfanylidene-1,4-benzoxazin-4-yl)acetic acid IUPAC Name: 2-(7-fluoro-2-propan-2-yl-3-sulfanylidene-1,4-benzoxazin-4-yl)acetic acid Traditional Name: 2-(7-fluoro-2-isopropyl-3-thioxo-1,4-benzoxazin-4-yl)acetic acid Formula: C13H14FNO3S MolecularWeight: 283.318563

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(=S)N(C2=C(O1)C=C(C=C2)F)CC(=O)O

Isomeric SMILES

CC(C)C1C(=S)N(C2=C(O1)C=C(C=C2)F)CC(=O)O

InChI

InChI=1S/C13H14FNO3S/c1-7(2)12-13(19)15(6-11(16)17)9-4-3-8(14)5-10(9)18-12/h3-5,7,12H,6H2,1-2H3,(H,16,17)