3-methylbutyl 2-[6-(2-chloranylethanoyl)-3-oxidanylidene-1,4-benzoxazin-4-yl]ethanoate

Systemtic Name: 3-methylbutyl 2-[6-(2-chloranylethanoyl)-3-oxidanylidene-1,4-benzoxazin-4-yl]ethanoate Openeye Name: isopentyl 2-[6-(2-chloroacetyl)-3-oxo-1,4-benzoxazin-4-yl]acetate CAS Name: 2-[6-(2-chloro-1-oxoethyl)-3-oxo-1,4-benzoxazin-4-yl]acetic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 2-[6-(2-chloroacetyl)-3-oxo-1,4-benzoxazin-4-yl]acetate Traditional Name: 2-[6-(2-chloroacetyl)-3-keto-1,4-benzoxazin-4-yl]acetic acid isoamyl ester Formula: C17H20ClNO5 MolecularWeight: 353.7974

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC(=O)CN1C(=O)COC2=C1C=C(C=C2)C(=O)CCl

Isomeric SMILES

CC(C)CCOC(=O)CN1C(=O)COC2=C1C=C(C=C2)C(=O)CCl

InChI

InChI=1S/C17H20ClNO5/c1-11(2)5-6-23-17(22)9-19-13-7-12(14(20)8-18)3-4-15(13)24-10-16(19)21/h3-4,7,11H,5-6,8-10H2,1-2H3