hexyl 2-[(2S)-6-ethanoyl-2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl]ethanoate

Systemtic Name: hexyl 2-[(2S)-6-ethanoyl-2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl]ethanoate Openeye Name: hexyl 2-[(2S)-6-acetyl-2-methyl-3-oxo-1,4-benzoxazin-4-yl]acetate CAS Name: 2-[(2S)-6-acetyl-2-methyl-3-oxo-1,4-benzoxazin-4-yl]acetic acid hexyl ester IUPAC Name: hexyl 2-[(2S)-6-acetyl-2-methyl-3-oxo-1,4-benzoxazin-4-yl]acetate Traditional Name: 2-[(2S)-6-acetyl-3-keto-2-methyl-1,4-benzoxazin-4-yl]acetic acid hexyl ester Formula: C19H25NO5 MolecularWeight: 347.4055

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)CN1C2=C(C=CC(=C2)C(=O)C)OC(C1=O)C

Isomeric SMILES

CCCCCCOC(=O)CN1C2=C(C=CC(=C2)C(=O)C)O[C@H](C1=O)C

InChI

InChI=1S/C19H25NO5/c1-4-5-6-7-10-24-18(22)12-20-16-11-15(13(2)21)8-9-17(16)25-14(3)19(20)23/h8-9,11,14H,4-7,10,12H2,1-3H3/t14-/m0/s1