1-[2-bis(2,2-dimethylaziridin-1-yl)phosphoryloxyethyl]-2-nitro-imidazole

Systemtic Name: 1-[2-bis(2,2-dimethylaziridin-1-yl)phosphoryloxyethyl]-2-nitro-imidazole Openeye Name: 1-[2-bis(2,2-dimethylaziridin-1-yl)phosphoryloxyethyl]-2-nitro-imidazole CAS Name: 1-[2-[bis(2,2-dimethyl-1-aziridinyl)phosphoryloxy]ethyl]-2-nitroimidazole IUPAC Name: 1-[2-bis(2,2-dimethylaziridin-1-yl)phosphoryloxyethyl]-2-nitroimidazole Traditional Name: 1-[2-bis(2,2-dimethylethylenimin-1-yl)phosphoryloxyethyl]-2-nitro-imidazole Formula: C13H22N5O4P MolecularWeight: 343.318641

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CN1P(=O)(N2CC2(C)C)OCCN3C=CN=C3[N+](=O)[O-])C

Isomeric SMILES

CC1(CN1P(=O)(N2CC2(C)C)OCCN3C=CN=C3[N+](=O)[O-])C

InChI

InChI=1S/C13H22N5O4P/c1-12(2)9-16(12)23(21,17-10-13(17,3)4)22-8-7-15-6-5-14-11(15)18(19)20/h5-6H,7-10H2,1-4H3