butyl (2S)-2-(6-butanoyl-3-oxidanylidene-1,4-benzoxazin-4-yl)propanoate

Systemtic Name: butyl (2S)-2-(6-butanoyl-3-oxidanylidene-1,4-benzoxazin-4-yl)propanoate Openeye Name: butyl (2S)-2-(6-butanoyl-3-oxo-1,4-benzoxazin-4-yl)propanoate CAS Name: (2S)-2-[3-oxo-6-(1-oxobutyl)-1,4-benzoxazin-4-yl]propanoic acid butyl ester IUPAC Name: butyl (2S)-2-(6-butanoyl-3-oxo-1,4-benzoxazin-4-yl)propanoate Traditional Name: (2S)-2-(6-butyryl-3-keto-1,4-benzoxazin-4-yl)propionic acid butyl ester Formula: C19H25NO5 MolecularWeight: 347.4055

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(C)N1C(=O)COC2=C1C=C(C=C2)C(=O)CCC

Isomeric SMILES

CCCCOC(=O)[C@H](C)N1C(=O)COC2=C1C=C(C=C2)C(=O)CCC

InChI

InChI=1S/C19H25NO5/c1-4-6-10-24-19(23)13(3)20-15-11-14(16(21)7-5-2)8-9-17(15)25-12-18(20)22/h8-9,11,13H,4-7,10,12H2,1-3H3/t13-/m0/s1