(2R)-2-[(2R)-6-ethanoyl-3-oxidanylidene-2-propan-2-yl-1,4-benzoxazin-4-yl]propanoic acid

Systemtic Name: (2R)-2-[(2R)-6-ethanoyl-3-oxidanylidene-2-propan-2-yl-1,4-benzoxazin-4-yl]propanoic acid Openeye Name: (2R)-2-[(2R)-6-acetyl-2-isopropyl-3-oxo-1,4-benzoxazin-4-yl]propanoic acid CAS Name: (2R)-2-[(2R)-6-acetyl-3-oxo-2-propan-2-yl-1,4-benzoxazin-4-yl]propanoic acid IUPAC Name: (2R)-2-[(2R)-6-acetyl-3-oxo-2-propan-2-yl-1,4-benzoxazin-4-yl]propanoic acid Traditional Name: (2R)-2-[(2R)-6-acetyl-2-isopropyl-3-keto-1,4-benzoxazin-4-yl]propionic acid Formula: C16H19NO5 MolecularWeight: 305.32576

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@H](C(=O)O)N1C2=C(C=CC(=C2)C(=O)C)O[C@@H](C1=O)C(C)C

InChI

InChI=1S/C16H19NO5/c1-8(2)14-15(19)17(9(3)16(20)21)12-7-11(10(4)18)5-6-13(12)22-14/h5-9,14H,1-4H3,(H,20,21)/t9-,14-/m1/s1