4-[[(2R)-6-ethanoyl-2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl]methyl]benzoate

Systemtic Name: 4-[[(2R)-6-ethanoyl-2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl]methyl]benzoate Openeye Name: 4-[[(2R)-6-acetyl-2-methyl-3-oxo-1,4-benzoxazin-4-yl]methyl]benzoate CAS Name: 4-[[(2R)-6-acetyl-2-methyl-3-oxo-1,4-benzoxazin-4-yl]methyl]benzoate IUPAC Name: 4-[[(2R)-6-acetyl-2-methyl-3-oxo-1,4-benzoxazin-4-yl]methyl]benzoate Traditional Name: 4-[[(2R)-6-acetyl-3-keto-2-methyl-1,4-benzoxazin-4-yl]methyl]benzoate Formula: C19H16NO5- MolecularWeight: 338.33404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=C(O1)C=CC(=C2)C(=O)C)CC3=CC=C(C=C3)C(=O)[O-]

Isomeric SMILES

C[C@@H]1C(=O)N(C2=C(O1)C=CC(=C2)C(=O)C)CC3=CC=C(C=C3)C(=O)[O-]

InChI

InChI=1S/C19H17NO5/c1-11(21)15-7-8-17-16(9-15)20(18(22)12(2)25-17)10-13-3-5-14(6-4-13)19(23)24/h3-9,12H,10H2,1-2H3,(H,23,24)/p-1/t12-/m1/s1