ethyl 3-(6-butanoyl-2,2-dimethyl-3-oxidanylidene-1,4-benzoxazin-4-yl)propanoate

Systemtic Name: ethyl 3-(6-butanoyl-2,2-dimethyl-3-oxidanylidene-1,4-benzoxazin-4-yl)propanoate Openeye Name: ethyl 3-(6-butanoyl-2,2-dimethyl-3-oxo-1,4-benzoxazin-4-yl)propanoate CAS Name: 3-[2,2-dimethyl-3-oxo-6-(1-oxobutyl)-1,4-benzoxazin-4-yl]propanoic acid ethyl ester IUPAC Name: ethyl 3-(6-butanoyl-2,2-dimethyl-3-oxo-1,4-benzoxazin-4-yl)propanoate Traditional Name: 3-(6-butyryl-3-keto-2,2-dimethyl-1,4-benzoxazin-4-yl)propionic acid ethyl ester Formula: C19H25NO5 MolecularWeight: 347.4055

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25NO5/c1-5-7-15(21)13-8-9-16-14(12-13)20(11-10-17(22)24-6-2)18(23)19(3,4)25-16/h8-9,12H,5-7,10-11H2,1-4H3