propyl (2S)-2-(6-butanoyl-3-oxidanylidene-1,4-benzoxazin-4-yl)butanoate

Systemtic Name: propyl (2S)-2-(6-butanoyl-3-oxidanylidene-1,4-benzoxazin-4-yl)butanoate Openeye Name: propyl (2S)-2-(6-butanoyl-3-oxo-1,4-benzoxazin-4-yl)butanoate CAS Name: (2S)-2-[3-oxo-6-(1-oxobutyl)-1,4-benzoxazin-4-yl]butanoic acid propyl ester IUPAC Name: propyl (2S)-2-(6-butanoyl-3-oxo-1,4-benzoxazin-4-yl)butanoate Traditional Name: (2S)-2-(6-butyryl-3-keto-1,4-benzoxazin-4-yl)butyric acid propyl ester Formula: C19H25NO5 MolecularWeight: 347.4055

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CC2=C(C=C1)OCC(=O)N2C(CC)C(=O)OCCC

Isomeric SMILES

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

InChI

InChI=1S/C19H25NO5/c1-4-7-16(21)13-8-9-17-15(11-13)20(18(22)12-25-17)14(6-3)19(23)24-10-5-2/h8-9,11,14H,4-7,10,12H2,1-3H3/t14-/m0/s1