(2-bromanyl-4,5-diethoxy-phenyl)methyl 4-[1,3-bis(oxidanylidene)isoindol-2-yl]butanoate

Systemtic Name: (2-bromanyl-4,5-diethoxy-phenyl)methyl 4-[1,3-bis(oxidanylidene)isoindol-2-yl]butanoate Openeye Name: (2-bromo-4,5-diethoxy-phenyl)methyl 4-(1,3-dioxoisoindolin-2-yl)butanoate CAS Name: 4-(1,3-dioxo-2-isoindolyl)butanoic acid (2-bromo-4,5-diethoxyphenyl)methyl ester IUPAC Name: (2-bromo-4,5-diethoxyphenyl)methyl 4-(1,3-dioxoisoindol-2-yl)butanoate Traditional Name: 4-phthalimidobutyric acid (2-bromo-4,5-diethoxy-benzyl) ester Formula: C23H24BrNO6 MolecularWeight: 490.34376

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)COC(=O)CCCN2C(=O)C3=CC=CC=C3C2=O)Br)OCC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)COC(=O)CCCN2C(=O)C3=CC=CC=C3C2=O)Br)OCC

InChI

InChI=1S/C23H24BrNO6/c1-3-29-19-12-15(18(24)13-20(19)30-4-2)14-31-21(26)10-7-11-25-22(27)16-8-5-6-9-17(16)23(25)28/h5-6,8-9,12-13H,3-4,7,10-11,14H2,1-2H3