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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CN1C(=O)COC2=C1C=C(C=C2)C(=O)C(C)Cl

Isomeric SMILES

CCCCOC(=O)CN1C(=O)COC2=C1C=C(C=C2)C(=O)[C@H](C)Cl

InChI

InChI=1S/C17H20ClNO5/c1-3-4-7-23-16(21)9-19-13-8-12(17(22)11(2)18)5-6-14(13)24-10-15(19)20/h5-6,8,11H,3-4,7,9-10H2,1-2H3/t11-/m0/s1