6-nitro-8-(2H-1,2,3,4-tetrazol-5-ylmethyl)-4,7,8,9-tetrahydro-1H-cyclopenta[f]quinoxaline-2,3-dione

Systemtic Name: 6-nitro-8-(2H-1,2,3,4-tetrazol-5-ylmethyl)-4,7,8,9-tetrahydro-1H-cyclopenta[f]quinoxaline-2,3-dione Openeye Name: 6-nitro-8-(2H-tetrazol-5-ylmethyl)-4,7,8,9-tetrahydro-1H-cyclopenta[f]quinoxaline-2,3-dione CAS Name: 6-nitro-8-(2H-tetrazol-5-ylmethyl)-4,7,8,9-tetrahydro-1H-cyclopenta[f]quinoxaline-2,3-dione IUPAC Name: 6-nitro-8-(2H-tetrazol-5-ylmethyl)-4,7,8,9-tetrahydro-1H-cyclopenta[f]quinoxaline-2,3-dione Traditional Name: 6-nitro-8-(2H-tetrazol-5-ylmethyl)-4,7,8,9-tetrahydro-1H-cyclopenta[f]quinoxaline-2,3-quinone Formula: C13H11N7O4 MolecularWeight: 329.27094

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC2=C3C(=CC(=C21)[N+](=O)[O-])NC(=O)C(=O)N3)CC4=NNN=N4

Isomeric SMILES

C1C(CC2=C3C(=CC(=C21)[N+](=O)[O-])NC(=O)C(=O)N3)CC4=NNN=N4

InChI

InChI=1S/C13H11N7O4/c21-12-13(22)15-11-7-2-5(3-10-16-18-19-17-10)1-6(7)9(20(23)24)4-8(11)14-12/h4-5H,1-3H2,(H,14,21)(H,15,22)(H,16,17,18,19)