bis(oxidanylidene)technetium; 1-[6-(2-methyl-4-nitro-imidazol-1-yl)hexyl]-1-aza-4,8,11-triazanidacyclotetradecane

Systemtic Name: bis(oxidanylidene)technetium; 1-[6-(2-methyl-4-nitro-imidazol-1-yl)hexyl]-1-aza-4,8,11-triazanidacyclotetradecane Openeye Name: dioxotechnetium; 1-[6-(2-methyl-4-nitro-imidazol-1-yl)hexyl]-1-aza-4,8,11-triazanidacyclotetradecane CAS Name: dioxotechnetium; 1-[6-(2-methyl-4-nitro-1-imidazolyl)hexyl]-1-aza-4,8,11-triazanidacyclotetradecane IUPAC Name: dioxotechnetium; 1-[6-(2-methyl-4-nitroimidazol-1-yl)hexyl]-1-aza-4,8,11-triazanidacyclotetradecane Traditional Name: diketotechnetium; 1-[6-(2-methyl-4-nitro-imidazol-1-yl)hexyl]-1-aza-4,8,11-triazanidacyclotetradecane Formula: C20H36N7O4Tc-3 MolecularWeight: 536.451556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CN1CCCCCCN2CCC[N-]CC[N-]CCC[N-]CC2)[N+](=O)[O-].O=[Tc]=O

Isomeric SMILES

CC1=NC(=CN1CCCCCCN2CCC[N-]CC[N-]CCC[N-]CC2)[N+](=O)[O-].O=[Tc]=O

InChI

InChI=1S/C20H36N7O2.2O.Tc/c1-19-24-20(27(28)29)18-26(19)16-5-3-2-4-14-25-15-7-10-22-12-11-21-8-6-9-23-13-17-25;;;/h18H,2-17H2,1H3;;;/q-3;;;