(2-oxidanylidene-4-propyl-chromen-7-yl) 4-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate

Systemtic Name: (2-oxidanylidene-4-propyl-chromen-7-yl) 4-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate Openeye Name: (2-oxo-4-propyl-chromen-7-yl) 4-(tert-butoxycarbonylamino)butanoate CAS Name: 4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]butanoic acid (2-oxo-4-propyl-1-benzopyran-7-yl) ester IUPAC Name: (2-oxo-4-propylchromen-7-yl) 4-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate Traditional Name: 4-(tert-butoxycarbonylamino)butyric acid (2-keto-4-propyl-chromen-7-yl) ester Formula: C21H27NO6 MolecularWeight: 389.44218

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)OC2=C1C=CC(=C2)OC(=O)CCCNC(=O)OC(C)(C)C

Isomeric SMILES

CCCC1=CC(=O)OC2=C1C=CC(=C2)OC(=O)CCCNC(=O)OC(C)(C)C

InChI

InChI=1S/C21H27NO6/c1-5-7-14-12-19(24)27-17-13-15(9-10-16(14)17)26-18(23)8-6-11-22-20(25)28-21(2,3)4/h9-10,12-13H,5-8,11H2,1-4H3,(H,22,25)