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

Systemtic Name: [(2S)-butan-2-yl] (2S)-2-(3-oxidanylidene-6-propanoyl-1,4-benzoxazin-4-yl)propanoate Openeye Name: [(1S)-1-methylpropyl] (2S)-2-(3-oxo-6-propanoyl-1,4-benzoxazin-4-yl)propanoate CAS Name: (2S)-2-[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-(3-oxo-6-propanoyl-1,4-benzoxazin-4-yl)propanoate Traditional Name: (2S)-2-(3-keto-6-propionyl-1,4-benzoxazin-4-yl)propionic acid [(1S)-1-methylpropyl] ester Formula: C18H23NO5 MolecularWeight: 333.37892

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC(=O)C(C)N1C(=O)COC2=C1C=C(C=C2)C(=O)CC

Isomeric SMILES

CC[C@H](C)OC(=O)[C@H](C)N1C(=O)COC2=C1C=C(C=C2)C(=O)CC

InChI

InChI=1S/C18H23NO5/c1-5-11(3)24-18(22)12(4)19-14-9-13(15(20)6-2)7-8-16(14)23-10-17(19)21/h7-9,11-12H,5-6,10H2,1-4H3/t11-,12-/m0/s1