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

Systemtic Name: butyl (2S)-2-(6-ethanoyl-3-oxidanylidene-1,4-benzoxazin-4-yl)propanoate Openeye Name: butyl (2S)-2-(6-acetyl-3-oxo-1,4-benzoxazin-4-yl)propanoate CAS Name: (2S)-2-(6-acetyl-3-oxo-1,4-benzoxazin-4-yl)propanoic acid butyl ester IUPAC Name: butyl (2S)-2-(6-acetyl-3-oxo-1,4-benzoxazin-4-yl)propanoate Traditional Name: (2S)-2-(6-acetyl-3-keto-1,4-benzoxazin-4-yl)propionic acid butyl ester Formula: C17H21NO5 MolecularWeight: 319.35234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21NO5/c1-4-5-8-22-17(21)11(2)18-14-9-13(12(3)19)6-7-15(14)23-10-16(18)20/h6-7,9,11H,4-5,8,10H2,1-3H3/t11-/m0/s1