[(2S)-butan-2-yl] (2S)-2-(6-ethanoyl-2,2-dimethyl-3-oxidanylidene-1,4-benzoxazin-4-yl)propanoate

Systemtic Name: [(2S)-butan-2-yl] (2S)-2-(6-ethanoyl-2,2-dimethyl-3-oxidanylidene-1,4-benzoxazin-4-yl)propanoate Openeye Name: [(1S)-1-methylpropyl] (2S)-2-(6-acetyl-2,2-dimethyl-3-oxo-1,4-benzoxazin-4-yl)propanoate CAS Name: (2S)-2-(6-acetyl-2,2-dimethyl-3-oxo-1,4-benzoxazin-4-yl)propanoic acid [(2S)-butan-2-yl] ester IUPAC Name: [(2S)-butan-2-yl] (2S)-2-(6-acetyl-2,2-dimethyl-3-oxo-1,4-benzoxazin-4-yl)propanoate Traditional Name: (2S)-2-(6-acetyl-3-keto-2,2-dimethyl-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)C)OC(C1=O)(C)C

Isomeric SMILES

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

InChI

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