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

Systemtic Name: [(2S)-butan-2-yl] (2S)-2-[(2R)-2-methyl-3-oxidanylidene-6-propanoyl-1,4-benzoxazin-4-yl]propanoate Openeye Name: [(1S)-1-methylpropyl] (2S)-2-[(2R)-2-methyl-3-oxo-6-propanoyl-1,4-benzoxazin-4-yl]propanoate CAS Name: (2S)-2-[(2R)-2-methyl-3-oxo-6-(1-oxopropyl)-1,4-benzoxazin-4-yl]propanoic acid [(2S)-butan-2-yl] ester IUPAC Name: [(2S)-butan-2-yl] (2S)-2-[(2R)-2-methyl-3-oxo-6-propanoyl-1,4-benzoxazin-4-yl]propanoate Traditional Name: (2S)-2-[(2R)-3-keto-2-methyl-6-propionyl-1,4-benzoxazin-4-yl]propionic acid [(1S)-1-methylpropyl] ester Formula: C19H25NO5 MolecularWeight: 347.4055

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC(=O)C(C)N1C2=C(C=CC(=C2)C(=O)CC)OC(C1=O)C

Isomeric SMILES

CC[C@H](C)OC(=O)[C@H](C)N1C2=C(C=CC(=C2)C(=O)CC)O[C@@H](C1=O)C

InChI

InChI=1S/C19H25NO5/c1-6-11(3)24-19(23)12(4)20-15-10-14(16(21)7-2)8-9-17(15)25-13(5)18(20)22/h8-13H,6-7H2,1-5H3/t11-,12-,13+/m0/s1