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

Systemtic Name: methyl (2S)-2-[6-[(2S)-2-chloranylpropanoyl]-3-oxidanylidene-1,4-benzoxazin-4-yl]propanoate Openeye Name: methyl (2S)-2-[6-[(2S)-2-chloropropanoyl]-3-oxo-1,4-benzoxazin-4-yl]propanoate CAS Name: (2S)-2-[6-[(2S)-2-chloro-1-oxopropyl]-3-oxo-1,4-benzoxazin-4-yl]propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[6-[(2S)-2-chloropropanoyl]-3-oxo-1,4-benzoxazin-4-yl]propanoate Traditional Name: (2S)-2-[6-[(2S)-2-chloropropanoyl]-3-keto-1,4-benzoxazin-4-yl]propionic acid methyl ester Formula: C15H16ClNO5 MolecularWeight: 325.74424

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H16ClNO5/c1-8(16)14(19)10-4-5-12-11(6-10)17(13(18)7-22-12)9(2)15(20)21-3/h4-6,8-9H,7H2,1-3H3/t8-,9-/m0/s1