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

Systemtic Name: methyl 2-[(2S)-6-[(2S)-2-chloranylpropanoyl]-3-oxidanylidene-2-propan-2-yl-1,4-benzoxazin-4-yl]ethanoate Openeye Name: methyl 2-[(2S)-6-[(2S)-2-chloropropanoyl]-2-isopropyl-3-oxo-1,4-benzoxazin-4-yl]acetate CAS Name: 2-[(2S)-6-[(2S)-2-chloro-1-oxopropyl]-3-oxo-2-propan-2-yl-1,4-benzoxazin-4-yl]acetic acid methyl ester IUPAC Name: methyl 2-[(2S)-6-[(2S)-2-chloropropanoyl]-3-oxo-2-propan-2-yl-1,4-benzoxazin-4-yl]acetate Traditional Name: 2-[(2S)-6-[(2S)-2-chloropropanoyl]-2-isopropyl-3-keto-1,4-benzoxazin-4-yl]acetic acid methyl ester Formula: C17H20ClNO5 MolecularWeight: 353.7974

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20ClNO5/c1-9(2)16-17(22)19(8-14(20)23-4)12-7-11(15(21)10(3)18)5-6-13(12)24-16/h5-7,9-10,16H,8H2,1-4H3/t10-,16-/m0/s1