2-(2-methyl-5-nitro-phenyl)-5,6,7,7a-tetrahydropyrrolo[1,2-c]imidazole-1,3-dione

Systemtic Name: 2-(2-methyl-5-nitro-phenyl)-5,6,7,7a-tetrahydropyrrolo[1,2-c]imidazole-1,3-dione Openeye Name: 2-(2-methyl-5-nitro-phenyl)-5,6,7,7a-tetrahydropyrrolo[1,2-c]imidazole-1,3-dione CAS Name: 2-(2-methyl-5-nitrophenyl)-5,6,7,7a-tetrahydropyrrolo[1,2-c]imidazole-1,3-dione IUPAC Name: 2-(2-methyl-5-nitrophenyl)-5,6,7,7a-tetrahydropyrrolo[1,2-c]imidazole-1,3-dione Traditional Name: 2-(2-methyl-5-nitro-phenyl)-5,6,7,7a-tetrahydropyrrol[1,2-c]imidazole-1,3-quinone Formula: C13H13N3O4 MolecularWeight: 275.26002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])N2C(=O)C3CCCN3C2=O

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])N2C(=O)C3CCCN3C2=O

InChI

InChI=1S/C13H13N3O4/c1-8-4-5-9(16(19)20)7-11(8)15-12(17)10-3-2-6-14(10)13(15)18/h4-5,7,10H,2-3,6H2,1H3