3-(6-chloranyl-3-oxidanylidene-1,4-benzoxazin-4-yl)propanoate

Systemtic Name: 3-(6-chloranyl-3-oxidanylidene-1,4-benzoxazin-4-yl)propanoate Openeye Name: 3-(6-chloro-3-oxo-1,4-benzoxazin-4-yl)propanoate CAS Name: 3-(6-chloro-3-oxo-1,4-benzoxazin-4-yl)propanoate IUPAC Name: 3-(6-chloro-3-oxo-1,4-benzoxazin-4-yl)propanoate Traditional Name: 3-(6-chloro-3-keto-1,4-benzoxazin-4-yl)propionate Formula: C11H9ClNO4- MolecularWeight: 254.64646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=C(O1)C=CC(=C2)Cl)CCC(=O)[O-]

Isomeric SMILES

C1C(=O)N(C2=C(O1)C=CC(=C2)Cl)CCC(=O)[O-]

InChI

InChI=1S/C11H10ClNO4/c12-7-1-2-9-8(5-7)13(4-3-11(15)16)10(14)6-17-9/h1-2,5H,3-4,6H2,(H,15,16)/p-1