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

Systemtic Name: ethyl 3-[(2S)-2-methyl-3-oxidanylidene-6-propanoyl-1,4-benzoxazin-4-yl]propanoate Openeye Name: ethyl 3-[(2S)-2-methyl-3-oxo-6-propanoyl-1,4-benzoxazin-4-yl]propanoate CAS Name: 3-[(2S)-2-methyl-3-oxo-6-(1-oxopropyl)-1,4-benzoxazin-4-yl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[(2S)-2-methyl-3-oxo-6-propanoyl-1,4-benzoxazin-4-yl]propanoate Traditional Name: 3-[(2S)-3-keto-2-methyl-6-propionyl-1,4-benzoxazin-4-yl]propionic acid ethyl ester Formula: C17H21NO5 MolecularWeight: 319.35234

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC2=C(C=C1)OC(C(=O)N2CCC(=O)OCC)C

Isomeric SMILES

CCC(=O)C1=CC2=C(C=C1)O[C@H](C(=O)N2CCC(=O)OCC)C

InChI

InChI=1S/C17H21NO5/c1-4-14(19)12-6-7-15-13(10-12)18(17(21)11(3)23-15)9-8-16(20)22-5-2/h6-7,10-11H,4-5,8-9H2,1-3H3/t11-/m0/s1