5-(4-oxidanylidene-2H-1,3-benzoxazin-3-yl)pentanoate

Systemtic Name: 5-(4-oxidanylidene-2H-1,3-benzoxazin-3-yl)pentanoate Openeye Name: 5-(4-oxo-2H-1,3-benzoxazin-3-yl)pentanoate CAS Name: 5-(4-oxo-2H-1,3-benzoxazin-3-yl)pentanoate IUPAC Name: 5-(4-oxo-2H-1,3-benzoxazin-3-yl)pentanoate Traditional Name: 5-(4-keto-2H-1,3-benzoxazin-3-yl)valerate Formula: C13H14NO4- MolecularWeight: 248.25456

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Descriptors Computed from Structure

Canonical SMILES:

C1N(C(=O)C2=CC=CC=C2O1)CCCCC(=O)[O-]

Isomeric SMILES

C1N(C(=O)C2=CC=CC=C2O1)CCCCC(=O)[O-]

InChI

InChI=1S/C13H15NO4/c15-12(16)7-3-4-8-14-9-18-11-6-2-1-5-10(11)13(14)17/h1-2,5-6H,3-4,7-9H2,(H,15,16)/p-1