methyl (2R)-2-(6-butanoyl-3-oxidanylidene-1,4-benzoxazin-4-yl)propanoate

Systemtic Name: methyl (2R)-2-(6-butanoyl-3-oxidanylidene-1,4-benzoxazin-4-yl)propanoate Openeye Name: methyl (2R)-2-(6-butanoyl-3-oxo-1,4-benzoxazin-4-yl)propanoate CAS Name: (2R)-2-[3-oxo-6-(1-oxobutyl)-1,4-benzoxazin-4-yl]propanoic acid methyl ester IUPAC Name: methyl (2R)-2-(6-butanoyl-3-oxo-1,4-benzoxazin-4-yl)propanoate Traditional Name: (2R)-2-(6-butyryl-3-keto-1,4-benzoxazin-4-yl)propionic acid methyl ester Formula: C16H19NO5 MolecularWeight: 305.32576

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CC2=C(C=C1)OCC(=O)N2C(C)C(=O)OC

Isomeric SMILES

CCCC(=O)C1=CC2=C(C=C1)OCC(=O)N2[C@H](C)C(=O)OC

InChI

InChI=1S/C16H19NO5/c1-4-5-13(18)11-6-7-14-12(8-11)17(15(19)9-22-14)10(2)16(20)21-3/h6-8,10H,4-5,9H2,1-3H3/t10-/m1/s1