1-[2-(2,6-dimethoxypyridin-3-yl)carbonylpyrazolidin-1-yl]-6-nitro-hexan-1-one

Systemtic Name: 1-[2-(2,6-dimethoxypyridin-3-yl)carbonylpyrazolidin-1-yl]-6-nitro-hexan-1-one Openeye Name: 1-[2-(2,6-dimethoxypyridine-3-carbonyl)pyrazolidin-1-yl]-6-nitro-hexan-1-one CAS Name: 1-[2-[(2,6-dimethoxy-3-pyridinyl)-oxomethyl]-1-pyrazolidinyl]-6-nitro-1-hexanone IUPAC Name: 1-[2-(2,6-dimethoxypyridine-3-carbonyl)pyrazolidin-1-yl]-6-nitrohexan-1-one Traditional Name: 1-[2-(2,6-dimethoxynicotinoyl)pyrazolidin-1-yl]-6-nitro-hexan-1-one Formula: C17H24N4O6 MolecularWeight: 380.39566

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=C(C=C1)C(=O)N2CCCN2C(=O)CCCCC[N+](=O)[O-])OC

Isomeric SMILES

COC1=NC(=C(C=C1)C(=O)N2CCCN2C(=O)CCCCC[N+](=O)[O-])OC

InChI

InChI=1S/C17H24N4O6/c1-26-14-9-8-13(16(18-14)27-2)17(23)20-11-6-10-19(20)15(22)7-4-3-5-12-21(24)25/h8-9H,3-7,10-12H2,1-2H3