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

Systemtic Name: 2-methylpropyl (2R)-2-(3-oxidanylidene-6-propanoyl-1,4-benzoxazin-4-yl)propanoate Openeye Name: isobutyl (2R)-2-(3-oxo-6-propanoyl-1,4-benzoxazin-4-yl)propanoate CAS Name: (2R)-2-[3-oxo-6-(1-oxopropyl)-1,4-benzoxazin-4-yl]propanoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl (2R)-2-(3-oxo-6-propanoyl-1,4-benzoxazin-4-yl)propanoate Traditional Name: (2R)-2-(3-keto-6-propionyl-1,4-benzoxazin-4-yl)propionic acid isobutyl ester Formula: C18H23NO5 MolecularWeight: 333.37892

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23NO5/c1-5-15(20)13-6-7-16-14(8-13)19(17(21)10-23-16)12(4)18(22)24-9-11(2)3/h6-8,11-12H,5,9-10H2,1-4H3/t12-/m1/s1