(phenylmethyl) 2-(6-ethanoyl-2,2-dimethyl-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoate

Systemtic Name: (phenylmethyl) 2-(6-ethanoyl-2,2-dimethyl-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoate Openeye Name: benzyl 2-(6-acetyl-2,2-dimethyl-3-oxo-1,4-benzoxazin-4-yl)acetate CAS Name: 2-(6-acetyl-2,2-dimethyl-3-oxo-1,4-benzoxazin-4-yl)acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(6-acetyl-2,2-dimethyl-3-oxo-1,4-benzoxazin-4-yl)acetate Traditional Name: 2-(6-acetyl-3-keto-2,2-dimethyl-1,4-benzoxazin-4-yl)acetic acid benzyl ester Formula: C21H21NO5 MolecularWeight: 367.39514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1)OC(C(=O)N2CC(=O)OCC3=CC=CC=C3)(C)C

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1)OC(C(=O)N2CC(=O)OCC3=CC=CC=C3)(C)C

InChI

InChI=1S/C21H21NO5/c1-14(23)16-9-10-18-17(11-16)22(20(25)21(2,3)27-18)12-19(24)26-13-15-7-5-4-6-8-15/h4-11H,12-13H2,1-3H3