(2-oxidanylideneoxolan-3-yl) 4-(4-methylpiperidin-1-yl)-3-nitro-benzoate

Systemtic Name: (2-oxidanylideneoxolan-3-yl) 4-(4-methylpiperidin-1-yl)-3-nitro-benzoate Openeye Name: (2-oxotetrahydrofuran-3-yl) 4-(4-methyl-1-piperidyl)-3-nitro-benzoate CAS Name: 4-(4-methyl-1-piperidinyl)-3-nitrobenzoic acid (2-oxo-3-oxolanyl) ester IUPAC Name: (2-oxooxolan-3-yl) 4-(4-methylpiperidin-1-yl)-3-nitrobenzoate Traditional Name: 4-(4-methylpiperidino)-3-nitro-benzoic acid (2-ketotetrahydrofuran-3-yl) ester Formula: C17H20N2O6 MolecularWeight: 348.3505

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)OC3CCOC3=O)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)OC3CCOC3=O)[N+](=O)[O-]

InChI

InChI=1S/C17H20N2O6/c1-11-4-7-18(8-5-11)13-3-2-12(10-14(13)19(22)23)16(20)25-15-6-9-24-17(15)21/h2-3,10-11,15H,4-9H2,1H3