5-bromanyl-2-[[(4-phenylmethoxyphenyl)amino]methyl]isoindole-1,3-dione

Systemtic Name: 5-bromanyl-2-[[(4-phenylmethoxyphenyl)amino]methyl]isoindole-1,3-dione Openeye Name: 2-[(4-benzyloxyanilino)methyl]-5-bromo-isoindoline-1,3-dione CAS Name: 5-bromo-2-[(4-phenylmethoxyanilino)methyl]isoindole-1,3-dione IUPAC Name: 5-bromo-2-[(4-phenylmethoxyanilino)methyl]isoindole-1,3-dione Traditional Name: 2-[(4-benzoxyanilino)methyl]-5-bromo-isoindoline-1,3-quinone Formula: C22H17BrN2O3 MolecularWeight: 437.28598

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)NCN3C(=O)C4=C(C3=O)C=C(C=C4)Br

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)NCN3C(=O)C4=C(C3=O)C=C(C=C4)Br

InChI

InChI=1S/C22H17BrN2O3/c23-16-6-11-19-20(12-16)22(27)25(21(19)26)14-24-17-7-9-18(10-8-17)28-13-15-4-2-1-3-5-15/h1-12,24H,13-14H2