tert-butyl (2Z)-2-[3-(furan-2-ylcarbonylamino)isoindol-1-ylidene]-3-oxidanylidene-butanoate

Systemtic Name: tert-butyl (2Z)-2-[3-(furan-2-ylcarbonylamino)isoindol-1-ylidene]-3-oxidanylidene-butanoate Openeye Name: tert-butyl (2Z)-2-[3-(furan-2-carbonylamino)isoindol-1-ylidene]-3-oxo-butanoate CAS Name: (2Z)-2-[3-[[2-furanyl(oxo)methyl]amino]-1-isoindolylidene]-3-oxobutanoic acid tert-butyl ester IUPAC Name: tert-butyl (2Z)-2-[3-(furan-2-carbonylamino)isoindol-1-ylidene]-3-oxobutanoate Traditional Name: (2Z)-2-[3-(2-furoylamino)isoindol-1-ylidene]-3-keto-butyric acid tert-butyl ester Formula: C21H20N2O5 MolecularWeight: 380.3939

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=C1C2=CC=CC=C2C(=N1)NC(=O)C3=CC=CO3)C(=O)OC(C)(C)C

Isomeric SMILES

CC(=O)/C(=C/1\C2=CC=CC=C2C(=N1)NC(=O)C3=CC=CO3)/C(=O)OC(C)(C)C

InChI

InChI=1S/C21H20N2O5/c1-12(24)16(20(26)28-21(2,3)4)17-13-8-5-6-9-14(13)18(22-17)23-19(25)15-10-7-11-27-15/h5-11H,1-4H3,(H,22,23,25)/b17-16-