4-[bis(oxidanyl)methyl]-3-oxidanidyl-1,6-dipropyl-imidazo[4,5-d]imidazol-3-ium-5-one

Systemtic Name: 4-[bis(oxidanyl)methyl]-3-oxidanidyl-1,6-dipropyl-imidazo[4,5-d]imidazol-3-ium-5-one Openeye Name: 4-(dihydroxymethyl)-3-oxido-1,6-dipropyl-imidazo[4,5-d]imidazol-3-ium-5-one CAS Name: 4-(dihydroxymethyl)-3-oxido-1,6-dipropyl-5-imidazo[4,5-d]imidazol-3-iumone IUPAC Name: 4-(dihydroxymethyl)-3-oxido-1,6-dipropylimidazo[4,5-d]imidazol-3-ium-5-one Traditional Name: 4-(dihydroxymethyl)-3-oxido-1,6-dipropyl-imidaz[4,5-d]imidazol-3-ium-5-one Formula: C11H18N4O4 MolecularWeight: 270.28502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=[N+](C2=C1N(C(=O)N2C(O)O)CCC)[O-]

Isomeric SMILES

CCCN1C=[N+](C2=C1N(C(=O)N2C(O)O)CCC)[O-]

InChI

InChI=1S/C11H18N4O4/c1-3-5-12-7-14(19)9-8(12)13(6-4-2)10(16)15(9)11(17)18/h7,11,17-18H,3-6H2,1-2H3