propan-2-yl (2S)-2-[6-(2-chloranylethanoyl)-3-oxidanylidene-1,4-benzoxazin-4-yl]butanoate

Systemtic Name: propan-2-yl (2S)-2-[6-(2-chloranylethanoyl)-3-oxidanylidene-1,4-benzoxazin-4-yl]butanoate Openeye Name: isopropyl (2S)-2-[6-(2-chloroacetyl)-3-oxo-1,4-benzoxazin-4-yl]butanoate CAS Name: (2S)-2-[6-(2-chloro-1-oxoethyl)-3-oxo-1,4-benzoxazin-4-yl]butanoic acid propan-2-yl ester IUPAC Name: propan-2-yl (2S)-2-[6-(2-chloroacetyl)-3-oxo-1,4-benzoxazin-4-yl]butanoate Traditional Name: (2S)-2-[6-(2-chloroacetyl)-3-keto-1,4-benzoxazin-4-yl]butyric acid isopropyl ester Formula: C17H20ClNO5 MolecularWeight: 353.7974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OC(C)C)N1C(=O)COC2=C1C=C(C=C2)C(=O)CCl

Isomeric SMILES

CC[C@@H](C(=O)OC(C)C)N1C(=O)COC2=C1C=C(C=C2)C(=O)CCl

InChI

InChI=1S/C17H20ClNO5/c1-4-12(17(22)24-10(2)3)19-13-7-11(14(20)8-18)5-6-15(13)23-9-16(19)21/h5-7,10,12H,4,8-9H2,1-3H3/t12-/m0/s1