[1-(3,4-dimethylphenyl)-1-oxidanylidene-propan-2-yl] 2-(3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoate

Systemtic Name: [1-(3,4-dimethylphenyl)-1-oxidanylidene-propan-2-yl] 2-(3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoate Openeye Name: [2-(3,4-dimethylphenyl)-1-methyl-2-oxo-ethyl] 2-(3-oxo-1,4-benzoxazin-4-yl)acetate CAS Name: 2-(3-oxo-1,4-benzoxazin-4-yl)acetic acid [1-(3,4-dimethylphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(3,4-dimethylphenyl)-1-oxopropan-2-yl] 2-(3-oxo-1,4-benzoxazin-4-yl)acetate Traditional Name: 2-(3-keto-1,4-benzoxazin-4-yl)acetic acid [2-(3,4-dimethylphenyl)-2-keto-1-methyl-ethyl] ester Formula: C21H21NO5 MolecularWeight: 367.39514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)C(C)OC(=O)CN2C(=O)COC3=CC=CC=C32)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)C(C)OC(=O)CN2C(=O)COC3=CC=CC=C32)C

InChI

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