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

Systemtic Name: methyl 2-[6-[(2S)-2-chloranylpropanoyl]-2,2-dimethyl-3-oxidanylidene-1,4-benzoxazin-4-yl]ethanoate Openeye Name: methyl 2-[6-[(2S)-2-chloropropanoyl]-2,2-dimethyl-3-oxo-1,4-benzoxazin-4-yl]acetate CAS Name: 2-[6-[(2S)-2-chloro-1-oxopropyl]-2,2-dimethyl-3-oxo-1,4-benzoxazin-4-yl]acetic acid methyl ester IUPAC Name: methyl 2-[6-[(2S)-2-chloropropanoyl]-2,2-dimethyl-3-oxo-1,4-benzoxazin-4-yl]acetate Traditional Name: 2-[6-[(2S)-2-chloropropanoyl]-3-keto-2,2-dimethyl-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(=O)C1=CC2=C(C=C1)OC(C(=O)N2CC(=O)OC)(C)C)Cl

Isomeric SMILES

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

InChI

InChI=1S/C16H18ClNO5/c1-9(17)14(20)10-5-6-12-11(7-10)18(8-13(19)22-4)15(21)16(2,3)23-12/h5-7,9H,8H2,1-4H3/t9-/m0/s1