2-(2-methoxyethyl)-8-nitro-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium

Systemtic Name: 2-(2-methoxyethyl)-8-nitro-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium Openeye Name: 2-(2-methoxyethyl)-8-nitro-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium CAS Name: 2-(2-methoxyethyl)-8-nitro-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium IUPAC Name: 2-(2-methoxyethyl)-8-nitro-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium Traditional Name: 2-(2-methoxyethyl)-8-nitro-1,2,3,4-tetrahydropyrazino[1,2-a]benzimidazol-2-ium Formula: C13H17N4O3+ MolecularWeight: 277.29908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCC[NH+]1CCN2C(=NC3=C2C=CC(=C3)[N+](=O)[O-])C1

Isomeric SMILES

COCC[NH+]1CCN2C(=NC3=C2C=CC(=C3)[N+](=O)[O-])C1

InChI

InChI=1S/C13H16N4O3/c1-20-7-6-15-4-5-16-12-3-2-10(17(18)19)8-11(12)14-13(16)9-15/h2-3,8H,4-7,9H2,1H3/p+1