(7-ethyl-2-oxidanylidene-chromen-4-yl)methyl 4-(2,2-dimethylpropanoylamino)butanoate

Systemtic Name: (7-ethyl-2-oxidanylidene-chromen-4-yl)methyl 4-(2,2-dimethylpropanoylamino)butanoate Openeye Name: (7-ethyl-2-oxo-chromen-4-yl)methyl 4-(2,2-dimethylpropanoylamino)butanoate CAS Name: 4-[(2,2-dimethyl-1-oxopropyl)amino]butanoic acid (7-ethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-ethyl-2-oxochromen-4-yl)methyl 4-(2,2-dimethylpropanoylamino)butanoate Traditional Name: 4-(pivaloylamino)butyric acid (7-ethyl-2-keto-chromen-4-yl)methyl ester Formula: C21H27NO5 MolecularWeight: 373.44278

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CCCNC(=O)C(C)(C)C

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)CCCNC(=O)C(C)(C)C

InChI

InChI=1S/C21H27NO5/c1-5-14-8-9-16-15(12-19(24)27-17(16)11-14)13-26-18(23)7-6-10-22-20(25)21(2,3)4/h8-9,11-12H,5-7,10,13H2,1-4H3,(H,22,25)