1-[(3,5-dinitrophenyl)methyl]-3-phenyl-pyrrole-2,5-dione

Systemtic Name: 1-[(3,5-dinitrophenyl)methyl]-3-phenyl-pyrrole-2,5-dione Openeye Name: 1-[(3,5-dinitrophenyl)methyl]-3-phenyl-pyrrole-2,5-dione CAS Name: 1-[(3,5-dinitrophenyl)methyl]-3-phenylpyrrole-2,5-dione IUPAC Name: 1-[(3,5-dinitrophenyl)methyl]-3-phenylpyrrole-2,5-dione Traditional Name: 1-(3,5-dinitrobenzyl)-3-phenyl-3-pyrroline-2,5-quinone Formula: C17H11N3O6 MolecularWeight: 353.28574

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=O)N(C2=O)CC3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=O)N(C2=O)CC3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H11N3O6/c21-16-9-15(12-4-2-1-3-5-12)17(22)18(16)10-11-6-13(19(23)24)8-14(7-11)20(25)26/h1-9H,10H2