[(2S)-butan-2-yl] 2-[(2S)-3-oxidanylidene-6-propanoyl-2-propan-2-yl-1,4-benzoxazin-4-yl]ethanoate

Systemtic Name: [(2S)-butan-2-yl] 2-[(2S)-3-oxidanylidene-6-propanoyl-2-propan-2-yl-1,4-benzoxazin-4-yl]ethanoate Openeye Name: [(1S)-1-methylpropyl] 2-[(2S)-2-isopropyl-3-oxo-6-propanoyl-1,4-benzoxazin-4-yl]acetate CAS Name: 2-[(2S)-3-oxo-6-(1-oxopropyl)-2-propan-2-yl-1,4-benzoxazin-4-yl]acetic acid [(2S)-butan-2-yl] ester IUPAC Name: [(2S)-butan-2-yl] 2-[(2S)-3-oxo-6-propanoyl-2-propan-2-yl-1,4-benzoxazin-4-yl]acetate Traditional Name: 2-[(2S)-2-isopropyl-3-keto-6-propionyl-1,4-benzoxazin-4-yl]acetic acid [(1S)-1-methylpropyl] ester Formula: C20H27NO5 MolecularWeight: 361.43208

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC(=O)CN1C2=C(C=CC(=C2)C(=O)CC)OC(C1=O)C(C)C

Isomeric SMILES

CC[C@H](C)OC(=O)CN1C2=C(C=CC(=C2)C(=O)CC)O[C@H](C1=O)C(C)C

InChI

InChI=1S/C20H27NO5/c1-6-13(5)25-18(23)11-21-15-10-14(16(22)7-2)8-9-17(15)26-19(12(3)4)20(21)24/h8-10,12-13,19H,6-7,11H2,1-5H3/t13-,19-/m0/s1