4-(6-chloranyl-4-oxidanylidene-2H-1,3-benzoxazin-3-yl)butanoic acid

Systemtic Name: 4-(6-chloranyl-4-oxidanylidene-2H-1,3-benzoxazin-3-yl)butanoic acid Openeye Name: 4-(6-chloro-4-oxo-2H-1,3-benzoxazin-3-yl)butanoic acid CAS Name: 4-(6-chloro-4-oxo-2H-1,3-benzoxazin-3-yl)butanoic acid IUPAC Name: 4-(6-chloro-4-oxo-2H-1,3-benzoxazin-3-yl)butanoic acid Traditional Name: 4-(6-chloro-4-keto-2H-1,3-benzoxazin-3-yl)butyric acid Formula: C12H12ClNO4 MolecularWeight: 269.68098

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Descriptors Computed from Structure

Canonical SMILES:

C1N(C(=O)C2=C(O1)C=CC(=C2)Cl)CCCC(=O)O

Isomeric SMILES

C1N(C(=O)C2=C(O1)C=CC(=C2)Cl)CCCC(=O)O

InChI

InChI=1S/C12H12ClNO4/c13-8-3-4-10-9(6-8)12(17)14(7-18-10)5-1-2-11(15)16/h3-4,6H,1-2,5,7H2,(H,15,16)