2-[(3-bromophenyl)methyl]-4-nitro-isoindole-1,3-dione

Systemtic Name: 2-[(3-bromophenyl)methyl]-4-nitro-isoindole-1,3-dione Openeye Name: 2-[(3-bromophenyl)methyl]-4-nitro-isoindoline-1,3-dione CAS Name: 2-[(3-bromophenyl)methyl]-4-nitroisoindole-1,3-dione IUPAC Name: 2-[(3-bromophenyl)methyl]-4-nitroisoindole-1,3-dione Traditional Name: 2-(3-bromobenzyl)-4-nitro-isoindoline-1,3-quinone Formula: C15H9BrN2O4 MolecularWeight: 361.14696

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)CN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)Br)CN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H9BrN2O4/c16-10-4-1-3-9(7-10)8-17-14(19)11-5-2-6-12(18(21)22)13(11)15(17)20/h1-7H,8H2