(7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 4-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate

Systemtic Name: (7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 4-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate Openeye Name: (7,8-dimethyl-2-oxo-chromen-4-yl)methyl 4-(tert-butoxycarbonylamino)butanoate CAS Name: 4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]butanoic acid (7,8-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7,8-dimethyl-2-oxochromen-4-yl)methyl 4-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate Traditional Name: 4-(tert-butoxycarbonylamino)butyric acid (2-keto-7,8-dimethyl-chromen-4-yl)methyl ester Formula: C21H27NO6 MolecularWeight: 389.44218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CC(=O)O2)COC(=O)CCCNC(=O)OC(C)(C)C)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CC(=O)O2)COC(=O)CCCNC(=O)OC(C)(C)C)C

InChI

InChI=1S/C21H27NO6/c1-13-8-9-16-15(11-18(24)27-19(16)14(13)2)12-26-17(23)7-6-10-22-20(25)28-21(3,4)5/h8-9,11H,6-7,10,12H2,1-5H3,(H,22,25)