2-(3-nitrophenyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione

Systemtic Name: 2-(3-nitrophenyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione Openeye Name: 2-(3-nitrophenyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione CAS Name: 2-(3-nitrophenyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione IUPAC Name: 2-(3-nitrophenyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione Traditional Name: 2-(3-nitrophenyl)-3a,4,7,7a-tetrahydroisoindole-1,3-quinone Formula: C14H12N2O4 MolecularWeight: 272.25608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C=CCC2C1C(=O)N(C2=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1C=CCC2C1C(=O)N(C2=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H12N2O4/c17-13-11-6-1-2-7-12(11)14(18)15(13)9-4-3-5-10(8-9)16(19)20/h1-5,8,11-12H,6-7H2