[2-(3,4-dimethylphenyl)-2-oxidanylidene-ethyl] 2-[(2S)-3-oxidanylidene-4H-1,4-benzoxazin-2-yl]ethanoate

Systemtic Name: [2-(3,4-dimethylphenyl)-2-oxidanylidene-ethyl] 2-[(2S)-3-oxidanylidene-4H-1,4-benzoxazin-2-yl]ethanoate Openeye Name: [2-(3,4-dimethylphenyl)-2-oxo-ethyl] 2-[(2S)-3-oxo-4H-1,4-benzoxazin-2-yl]acetate CAS Name: 2-[(2S)-3-oxo-4H-1,4-benzoxazin-2-yl]acetic acid [2-(3,4-dimethylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dimethylphenyl)-2-oxoethyl] 2-[(2S)-3-oxo-4H-1,4-benzoxazin-2-yl]acetate Traditional Name: 2-[(2S)-3-keto-4H-1,4-benzoxazin-2-yl]acetic acid [2-(3,4-dimethylphenyl)-2-keto-ethyl] ester Formula: C20H19NO5 MolecularWeight: 353.36856

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)COC(=O)CC2C(=O)NC3=CC=CC=C3O2)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)COC(=O)C[C@H]2C(=O)NC3=CC=CC=C3O2)C

InChI

InChI=1S/C20H19NO5/c1-12-7-8-14(9-13(12)2)16(22)11-25-19(23)10-18-20(24)21-15-5-3-4-6-17(15)26-18/h3-9,18H,10-11H2,1-2H3,(H,21,24)/t18-/m0/s1