2-[(2S)-4-ethyl-7-methyl-3-oxidanylidene-1,4-benzoxazin-2-yl]ethanoic acid

Systemtic Name: 2-[(2S)-4-ethyl-7-methyl-3-oxidanylidene-1,4-benzoxazin-2-yl]ethanoic acid Openeye Name: 2-[(2S)-4-ethyl-7-methyl-3-oxo-1,4-benzoxazin-2-yl]acetic acid CAS Name: 2-[(2S)-4-ethyl-7-methyl-3-oxo-1,4-benzoxazin-2-yl]acetic acid IUPAC Name: 2-[(2S)-4-ethyl-7-methyl-3-oxo-1,4-benzoxazin-2-yl]acetic acid Traditional Name: 2-[(2S)-4-ethyl-3-keto-7-methyl-1,4-benzoxazin-2-yl]acetic acid Formula: C13H15NO4 MolecularWeight: 249.2625

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C)OC(C1=O)CC(=O)O

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C)O[C@H](C1=O)CC(=O)O

InChI

InChI=1S/C13H15NO4/c1-3-14-9-5-4-8(2)6-10(9)18-11(13(14)17)7-12(15)16/h4-6,11H,3,7H2,1-2H3,(H,15,16)/t11-/m0/s1