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

Systemtic Name: ethyl 3-[(2R)-6-butanoyl-2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl]propanoate Openeye Name: ethyl 3-[(2R)-6-butanoyl-2-methyl-3-oxo-1,4-benzoxazin-4-yl]propanoate CAS Name: 3-[(2R)-2-methyl-3-oxo-6-(1-oxobutyl)-1,4-benzoxazin-4-yl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[(2R)-6-butanoyl-2-methyl-3-oxo-1,4-benzoxazin-4-yl]propanoate Traditional Name: 3-[(2R)-6-butyryl-3-keto-2-methyl-1,4-benzoxazin-4-yl]propionic acid ethyl ester Formula: C18H23NO5 MolecularWeight: 333.37892

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCC(=O)C1=CC2=C(C=C1)O[C@@H](C(=O)N2CCC(=O)OCC)C

InChI

InChI=1S/C18H23NO5/c1-4-6-15(20)13-7-8-16-14(11-13)19(18(22)12(3)24-16)10-9-17(21)23-5-2/h7-8,11-12H,4-6,9-10H2,1-3H3/t12-/m1/s1