2-(4-bromanyl-3-methyl-phenyl)-5-phenoxy-isoindole-1,3-dione

Systemtic Name: 2-(4-bromanyl-3-methyl-phenyl)-5-phenoxy-isoindole-1,3-dione Openeye Name: 2-(4-bromo-3-methyl-phenyl)-5-phenoxy-isoindoline-1,3-dione CAS Name: 2-(4-bromo-3-methylphenyl)-5-phenoxyisoindole-1,3-dione IUPAC Name: 2-(4-bromo-3-methylphenyl)-5-phenoxyisoindole-1,3-dione Traditional Name: 2-(4-bromo-3-methyl-phenyl)-5-phenoxy-isoindoline-1,3-quinone Formula: C21H14BrNO3 MolecularWeight: 408.24476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)OC4=CC=CC=C4)Br

Isomeric SMILES

CC1=C(C=CC(=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)OC4=CC=CC=C4)Br

InChI

InChI=1S/C21H14BrNO3/c1-13-11-14(7-10-19(13)22)23-20(24)17-9-8-16(12-18(17)21(23)25)26-15-5-3-2-4-6-15/h2-12H,1H3