4-[2-(6-chloranyl-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoylamino]butanoic acid

Systemtic Name: 4-[2-(6-chloranyl-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoylamino]butanoic acid Openeye Name: 4-[[2-(6-chloro-3-oxo-1,4-benzoxazin-4-yl)acetyl]amino]butanoic acid CAS Name: 4-[[2-(6-chloro-3-oxo-1,4-benzoxazin-4-yl)-1-oxoethyl]amino]butanoic acid IUPAC Name: 4-[[2-(6-chloro-3-oxo-1,4-benzoxazin-4-yl)acetyl]amino]butanoic acid Traditional Name: 4-[[2-(6-chloro-3-keto-1,4-benzoxazin-4-yl)acetyl]amino]butyric acid Formula: C14H15ClN2O5 MolecularWeight: 326.7323

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=C(O1)C=CC(=C2)Cl)CC(=O)NCCCC(=O)O

Isomeric SMILES

C1C(=O)N(C2=C(O1)C=CC(=C2)Cl)CC(=O)NCCCC(=O)O

InChI

InChI=1S/C14H15ClN2O5/c15-9-3-4-11-10(6-9)17(13(19)8-22-11)7-12(18)16-5-1-2-14(20)21/h3-4,6H,1-2,5,7-8H2,(H,16,18)(H,20,21)