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

Systemtic Name: propan-2-yl (2S)-2-[6-(2-chloranylethanoyl)-3-oxidanylidene-1,4-benzoxazin-4-yl]propanoate Openeye Name: isopropyl (2S)-2-[6-(2-chloroacetyl)-3-oxo-1,4-benzoxazin-4-yl]propanoate CAS Name: (2S)-2-[6-(2-chloro-1-oxoethyl)-3-oxo-1,4-benzoxazin-4-yl]propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl (2S)-2-[6-(2-chloroacetyl)-3-oxo-1,4-benzoxazin-4-yl]propanoate Traditional Name: (2S)-2-[6-(2-chloroacetyl)-3-keto-1,4-benzoxazin-4-yl]propionic acid isopropyl ester Formula: C16H18ClNO5 MolecularWeight: 339.77082

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18ClNO5/c1-9(2)23-16(21)10(3)18-12-6-11(13(19)7-17)4-5-14(12)22-8-15(18)20/h4-6,9-10H,7-8H2,1-3H3/t10-/m0/s1