(2S)-2-(6-ethanoyl-2,3-dihydro-1,4-benzoxazin-4-yl)propanoic acid

Systemtic Name: (2S)-2-(6-ethanoyl-2,3-dihydro-1,4-benzoxazin-4-yl)propanoic acid Openeye Name: (2S)-2-(6-acetyl-2,3-dihydro-1,4-benzoxazin-4-yl)propanoic acid CAS Name: (2S)-2-(6-acetyl-2,3-dihydro-1,4-benzoxazin-4-yl)propanoic acid IUPAC Name: (2S)-2-(6-acetyl-2,3-dihydro-1,4-benzoxazin-4-yl)propanoic acid Traditional Name: (2S)-2-(6-acetyl-2,3-dihydro-1,4-benzoxazin-4-yl)propionic acid Formula: C13H15NO4 MolecularWeight: 249.2625

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)N1CCOC2=C1C=C(C=C2)C(=O)C

Isomeric SMILES

C[C@@H](C(=O)O)N1CCOC2=C1C=C(C=C2)C(=O)C

InChI

InChI=1S/C13H15NO4/c1-8(13(16)17)14-5-6-18-12-4-3-10(9(2)15)7-11(12)14/h3-4,7-8H,5-6H2,1-2H3,(H,16,17)/t8-/m0/s1