methyl 2-[(2R)-3-oxidanylidene-6-propanoyl-2-propan-2-yl-1,4-benzoxazin-4-yl]ethanoate

Systemtic Name: methyl 2-[(2R)-3-oxidanylidene-6-propanoyl-2-propan-2-yl-1,4-benzoxazin-4-yl]ethanoate Openeye Name: methyl 2-[(2R)-2-isopropyl-3-oxo-6-propanoyl-1,4-benzoxazin-4-yl]acetate CAS Name: 2-[(2R)-3-oxo-6-(1-oxopropyl)-2-propan-2-yl-1,4-benzoxazin-4-yl]acetic acid methyl ester IUPAC Name: methyl 2-[(2R)-3-oxo-6-propanoyl-2-propan-2-yl-1,4-benzoxazin-4-yl]acetate Traditional Name: 2-[(2R)-2-isopropyl-3-keto-6-propionyl-1,4-benzoxazin-4-yl]acetic acid methyl ester Formula: C17H21NO5 MolecularWeight: 319.35234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC2=C(C=C1)OC(C(=O)N2CC(=O)OC)C(C)C

Isomeric SMILES

CCC(=O)C1=CC2=C(C=C1)O[C@@H](C(=O)N2CC(=O)OC)C(C)C

InChI

InChI=1S/C17H21NO5/c1-5-13(19)11-6-7-14-12(8-11)18(9-15(20)22-4)17(21)16(23-14)10(2)3/h6-8,10,16H,5,9H2,1-4H3/t16-/m1/s1