3-ethyl-1-(4-methyl-2-nitro-phenyl)-4a,7a-dihydro-4H-pyrrolo[3,4-b]pyridine-5,7-dione

Systemtic Name: 3-ethyl-1-(4-methyl-2-nitro-phenyl)-4a,7a-dihydro-4H-pyrrolo[3,4-b]pyridine-5,7-dione Openeye Name: 3-ethyl-1-(4-methyl-2-nitro-phenyl)-4a,7a-dihydro-4H-pyrrolo[3,4-b]pyridine-5,7-dione CAS Name: 3-ethyl-1-(4-methyl-2-nitrophenyl)-4a,7a-dihydro-4H-pyrrolo[3,4-b]pyridine-5,7-dione IUPAC Name: 3-ethyl-1-(4-methyl-2-nitrophenyl)-4a,7a-dihydro-4H-pyrrolo[3,4-b]pyridine-5,7-dione Traditional Name: 3-ethyl-1-(4-methyl-2-nitro-phenyl)-4a,7a-dihydro-4H-pyrrolo[3,4-b]pyridine-5,7-quinone Formula: C16H17N3O4 MolecularWeight: 315.32388

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN(C2C(C1)C(=O)NC2=O)C3=C(C=C(C=C3)C)[N+](=O)[O-]

Isomeric SMILES

CCC1=CN(C2C(C1)C(=O)NC2=O)C3=C(C=C(C=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C16H17N3O4/c1-3-10-7-11-14(16(21)17-15(11)20)18(8-10)12-5-4-9(2)6-13(12)19(22)23/h4-6,8,11,14H,3,7H2,1-2H3,(H,17,20,21)