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

Systemtic Name: [(2S)-butan-2-yl] 2-(3-oxidanylidene-6-propanoyl-1,4-benzoxazin-4-yl)ethanoate Openeye Name: [(1S)-1-methylpropyl] 2-(3-oxo-6-propanoyl-1,4-benzoxazin-4-yl)acetate CAS Name: 2-[3-oxo-6-(1-oxopropyl)-1,4-benzoxazin-4-yl]acetic acid [(2S)-butan-2-yl] ester IUPAC Name: [(2S)-butan-2-yl] 2-(3-oxo-6-propanoyl-1,4-benzoxazin-4-yl)acetate Traditional Name: 2-(3-keto-6-propionyl-1,4-benzoxazin-4-yl)acetic acid [(1S)-1-methylpropyl] ester Formula: C17H21NO5 MolecularWeight: 319.35234

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC(=O)CN1C(=O)COC2=C1C=C(C=C2)C(=O)CC

Isomeric SMILES

CC[C@H](C)OC(=O)CN1C(=O)COC2=C1C=C(C=C2)C(=O)CC

InChI

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