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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(=O)N(C2=C(O1)C=CC(=C2)C(=O)CCl)CC(=O)OC

Isomeric SMILES

CC(C)[C@H]1C(=O)N(C2=C(O1)C=CC(=C2)C(=O)CCl)CC(=O)OC

InChI

InChI=1S/C16H18ClNO5/c1-9(2)15-16(21)18(8-14(20)22-3)11-6-10(12(19)7-17)4-5-13(11)23-15/h4-6,9,15H,7-8H2,1-3H3/t15-/m0/s1