(5-methyl-2-oxidanylidene-oxolan-3-yl) 1-(2-nitrophenyl)piperidine-4-carboxylate

Systemtic Name: (5-methyl-2-oxidanylidene-oxolan-3-yl) 1-(2-nitrophenyl)piperidine-4-carboxylate Openeye Name: (5-methyl-2-oxo-tetrahydrofuran-3-yl) 1-(2-nitrophenyl)piperidine-4-carboxylate CAS Name: 1-(2-nitrophenyl)-4-piperidinecarboxylic acid (5-methyl-2-oxo-3-oxolanyl) ester IUPAC Name: (5-methyl-2-oxooxolan-3-yl) 1-(2-nitrophenyl)piperidine-4-carboxylate Traditional Name: 1-(2-nitrophenyl)isonipecotic acid (2-keto-5-methyl-tetrahydrofuran-3-yl) ester Formula: C17H20N2O6 MolecularWeight: 348.3505

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C(=O)O1)OC(=O)C2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1CC(C(=O)O1)OC(=O)C2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-]

InChI

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