2-methylpropyl (2R)-2-(6-butanoyl-3-oxidanylidene-1,4-benzoxazin-4-yl)propanoate

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CC2=C(C=C1)OCC(=O)N2C(C)C(=O)OCC(C)C

Isomeric SMILES

CCCC(=O)C1=CC2=C(C=C1)OCC(=O)N2[C@H](C)C(=O)OCC(C)C

InChI

InChI=1S/C19H25NO5/c1-5-6-16(21)14-7-8-17-15(9-14)20(18(22)11-24-17)13(4)19(23)25-10-12(2)3/h7-9,12-13H,5-6,10-11H2,1-4H3/t13-/m1/s1