2-(4-bromanyl-1-phenyl-butyl)isoindole-1,3-dione

Systemtic Name: 2-(4-bromanyl-1-phenyl-butyl)isoindole-1,3-dione Openeye Name: 2-(4-bromo-1-phenyl-butyl)isoindoline-1,3-dione CAS Name: 2-(4-bromo-1-phenylbutyl)isoindole-1,3-dione IUPAC Name: 2-(4-bromo-1-phenylbutyl)isoindole-1,3-dione Traditional Name: 2-(4-bromo-1-phenyl-butyl)isoindoline-1,3-quinone Formula: C18H16BrNO2 MolecularWeight: 358.22914

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CCCBr)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

C1=CC=C(C=C1)C(CCCBr)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C18H16BrNO2/c19-12-6-11-16(13-7-2-1-3-8-13)20-17(21)14-9-4-5-10-15(14)18(20)22/h1-5,7-10,16H,6,11-12H2