(3-bromophenyl)methyl 4-[1,3-bis(oxidanylidene)isoindol-2-yl]butanoate

Systemtic Name: (3-bromophenyl)methyl 4-[1,3-bis(oxidanylidene)isoindol-2-yl]butanoate Openeye Name: (3-bromophenyl)methyl 4-(1,3-dioxoisoindolin-2-yl)butanoate CAS Name: 4-(1,3-dioxo-2-isoindolyl)butanoic acid (3-bromophenyl)methyl ester IUPAC Name: (3-bromophenyl)methyl 4-(1,3-dioxoisoindol-2-yl)butanoate Traditional Name: 4-phthalimidobutyric acid (3-bromobenzyl) ester Formula: C19H16BrNO4 MolecularWeight: 402.23864

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCC(=O)OCC3=CC(=CC=C3)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCC(=O)OCC3=CC(=CC=C3)Br

InChI

InChI=1S/C19H16BrNO4/c20-14-6-3-5-13(11-14)12-25-17(22)9-4-10-21-18(23)15-7-1-2-8-16(15)19(21)24/h1-3,5-8,11H,4,9-10,12H2