2-[(3-bromophenyl)methyl]-2-(4-chlorophenyl)indene-1,3-dione

Systemtic Name: 2-[(3-bromophenyl)methyl]-2-(4-chlorophenyl)indene-1,3-dione Openeye Name: 2-[(3-bromophenyl)methyl]-2-(4-chlorophenyl)indane-1,3-dione CAS Name: 2-[(3-bromophenyl)methyl]-2-(4-chlorophenyl)indene-1,3-dione IUPAC Name: 2-[(3-bromophenyl)methyl]-2-(4-chlorophenyl)indene-1,3-dione Traditional Name: 2-(3-bromobenzyl)-2-(4-chlorophenyl)indane-1,3-quinone Formula: C22H14BrClO2 MolecularWeight: 425.70236

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C(C2=O)(CC3=CC(=CC=C3)Br)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C(C2=O)(CC3=CC(=CC=C3)Br)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H14BrClO2/c23-16-5-3-4-14(12-16)13-22(15-8-10-17(24)11-9-15)20(25)18-6-1-2-7-19(18)21(22)26/h1-12H,13H2