2-(4-nitroimidazol-1-yl)-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-ethanamide

Systemtic Name: 2-(4-nitroimidazol-1-yl)-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-ethanamide Openeye Name: 2-(4-nitroimidazol-1-yl)-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-acetamide CAS Name: 2-(4-nitro-1-imidazolyl)-N-(5-spiro[1,3-benzodioxole-2,1'-cyclopentane]yl)acetamide IUPAC Name: 2-(4-nitroimidazol-1-yl)-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylacetamide Traditional Name: 2-(4-nitroimidazol-1-yl)-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-acetamide Formula: C16H16N4O5 MolecularWeight: 344.32204

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(C1)OC3=C(O2)C=C(C=C3)NC(=O)CN4C=C(N=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCC2(C1)OC3=C(O2)C=C(C=C3)NC(=O)CN4C=C(N=C4)[N+](=O)[O-]

InChI

InChI=1S/C16H16N4O5/c21-15(9-19-8-14(17-10-19)20(22)23)18-11-3-4-12-13(7-11)25-16(24-12)5-1-2-6-16/h3-4,7-8,10H,1-2,5-6,9H2,(H,18,21)