2-(3-oxidanylidene-4-propyl-1,4-benzoxazin-6-yl)ethanoic acid

Systemtic Name: 2-(3-oxidanylidene-4-propyl-1,4-benzoxazin-6-yl)ethanoic acid Openeye Name: 2-(3-oxo-4-propyl-1,4-benzoxazin-6-yl)acetic acid CAS Name: 2-(3-oxo-4-propyl-1,4-benzoxazin-6-yl)acetic acid IUPAC Name: 2-(3-oxo-4-propyl-1,4-benzoxazin-6-yl)acetic acid Traditional Name: 2-(3-keto-4-propyl-1,4-benzoxazin-6-yl)acetic acid Formula: C13H15NO4 MolecularWeight: 249.2625

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)COC2=C1C=C(C=C2)CC(=O)O

Isomeric SMILES

CCCN1C(=O)COC2=C1C=C(C=C2)CC(=O)O

InChI

InChI=1S/C13H15NO4/c1-2-5-14-10-6-9(7-13(16)17)3-4-11(10)18-8-12(14)15/h3-4,6H,2,5,7-8H2,1H3,(H,16,17)