ethyl 3-(6-butanoyl-3-oxidanylidene-1,4-benzoxazin-4-yl)propanoate

Systemtic Name: ethyl 3-(6-butanoyl-3-oxidanylidene-1,4-benzoxazin-4-yl)propanoate Openeye Name: ethyl 3-(6-butanoyl-3-oxo-1,4-benzoxazin-4-yl)propanoate CAS Name: 3-[3-oxo-6-(1-oxobutyl)-1,4-benzoxazin-4-yl]propanoic acid ethyl ester IUPAC Name: ethyl 3-(6-butanoyl-3-oxo-1,4-benzoxazin-4-yl)propanoate Traditional Name: 3-(6-butyryl-3-keto-1,4-benzoxazin-4-yl)propionic acid ethyl ester Formula: C17H21NO5 MolecularWeight: 319.35234

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CC2=C(C=C1)OCC(=O)N2CCC(=O)OCC

Isomeric SMILES

CCCC(=O)C1=CC2=C(C=C1)OCC(=O)N2CCC(=O)OCC

InChI

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