propan-2-yl (2S)-2-(3-oxidanylidene-6-propanoyl-1,4-benzoxazin-4-yl)butanoate

Systemtic Name: propan-2-yl (2S)-2-(3-oxidanylidene-6-propanoyl-1,4-benzoxazin-4-yl)butanoate Openeye Name: isopropyl (2S)-2-(3-oxo-6-propanoyl-1,4-benzoxazin-4-yl)butanoate CAS Name: (2S)-2-[3-oxo-6-(1-oxopropyl)-1,4-benzoxazin-4-yl]butanoic acid propan-2-yl ester IUPAC Name: propan-2-yl (2S)-2-(3-oxo-6-propanoyl-1,4-benzoxazin-4-yl)butanoate Traditional Name: (2S)-2-(3-keto-6-propionyl-1,4-benzoxazin-4-yl)butyric acid isopropyl ester Formula: C18H23NO5 MolecularWeight: 333.37892

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OC(C)C)N1C(=O)COC2=C1C=C(C=C2)C(=O)CC

Isomeric SMILES

CC[C@@H](C(=O)OC(C)C)N1C(=O)COC2=C1C=C(C=C2)C(=O)CC

InChI

InChI=1S/C18H23NO5/c1-5-13(18(22)24-11(3)4)19-14-9-12(15(20)6-2)7-8-16(14)23-10-17(19)21/h7-9,11,13H,5-6,10H2,1-4H3/t13-/m0/s1