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

Systemtic Name: [1,3-bis(oxidanylidene)isoindol-2-yl]methyl 4-(5-bromanyl-2-methoxy-phenyl)-4-oxidanylidene-butanoate Openeye Name: (1,3-dioxoisoindolin-2-yl)methyl 4-(5-bromo-2-methoxy-phenyl)-4-oxo-butanoate CAS Name: 4-(5-bromo-2-methoxyphenyl)-4-oxobutanoic acid (1,3-dioxo-2-isoindolyl)methyl ester IUPAC Name: (1,3-dioxoisoindol-2-yl)methyl 4-(5-bromo-2-methoxyphenyl)-4-oxobutanoate Traditional Name: 4-(5-bromo-2-methoxy-phenyl)-4-keto-butyric acid phthalimidomethyl ester Formula: C20H16BrNO6 MolecularWeight: 446.24814

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C(=O)CCC(=O)OCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C(=O)CCC(=O)OCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C20H16BrNO6/c1-27-17-8-6-12(21)10-15(17)16(23)7-9-18(24)28-11-22-19(25)13-4-2-3-5-14(13)20(22)26/h2-6,8,10H,7,9,11H2,1H3