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

Systemtic Name: pentyl 2-[(2S)-6-ethanoyl-2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl]ethanoate Openeye Name: pentyl 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 pentyl ester IUPAC Name: pentyl 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 amyl ester Formula: C18H23NO5 MolecularWeight: 333.37892

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23NO5/c1-4-5-6-9-23-17(21)11-19-15-10-14(12(2)20)7-8-16(15)24-13(3)18(19)22/h7-8,10,13H,4-6,9,11H2,1-3H3/t13-/m0/s1