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

Systemtic Name: (2,3,6-trimethylphenyl) 2-[(2R)-2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl]ethanoate Openeye Name: (2,3,6-trimethylphenyl) 2-[(2R)-2-methyl-3-oxo-1,4-benzoxazin-4-yl]acetate CAS Name: 2-[(2R)-2-methyl-3-oxo-1,4-benzoxazin-4-yl]acetic acid (2,3,6-trimethylphenyl) ester IUPAC Name: (2,3,6-trimethylphenyl) 2-[(2R)-2-methyl-3-oxo-1,4-benzoxazin-4-yl]acetate Traditional Name: 2-[(2R)-3-keto-2-methyl-1,4-benzoxazin-4-yl]acetic acid (2,3,6-trimethylphenyl) ester Formula: C20H21NO4 MolecularWeight: 339.38504

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=CC=CC=C2O1)CC(=O)OC3=C(C=CC(=C3C)C)C

Isomeric SMILES

C[C@@H]1C(=O)N(C2=CC=CC=C2O1)CC(=O)OC3=C(C=CC(=C3C)C)C

InChI

InChI=1S/C20H21NO4/c1-12-9-10-13(2)19(14(12)3)25-18(22)11-21-16-7-5-6-8-17(16)24-15(4)20(21)23/h5-10,15H,11H2,1-4H3/t15-/m1/s1