2-methyl-1-[(1S,4R)-4-(2-methyl-4-nitro-imidazol-1-yl)cyclopent-2-en-1-yl]-4-nitro-imidazole

Systemtic Name: 2-methyl-1-[(1S,4R)-4-(2-methyl-4-nitro-imidazol-1-yl)cyclopent-2-en-1-yl]-4-nitro-imidazole Openeye Name: 2-methyl-1-[(1S,4R)-4-(2-methyl-4-nitro-imidazol-1-yl)cyclopent-2-en-1-yl]-4-nitro-imidazole CAS Name: 2-methyl-1-[(1S,4R)-4-(2-methyl-4-nitro-1-imidazolyl)-1-cyclopent-2-enyl]-4-nitroimidazole IUPAC Name: 2-methyl-1-[(1S,4R)-4-(2-methyl-4-nitroimidazol-1-yl)cyclopent-2-en-1-yl]-4-nitroimidazole Traditional Name: 2-methyl-1-[(1S,4R)-4-(2-methyl-4-nitro-imidazol-1-yl)cyclopent-2-en-1-yl]-4-nitro-imidazole Formula: C13H14N6O4 MolecularWeight: 318.28806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CN1C2CC(C=C2)N3C=C(N=C3C)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=CN1[C@@H]2C[C@@H](C=C2)N3C=C(N=C3C)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H14N6O4/c1-8-14-12(18(20)21)6-16(8)10-3-4-11(5-10)17-7-13(19(22)23)15-9(17)2/h3-4,6-7,10-11H,5H2,1-2H3/t10-,11+