(5-phenyl-1,2-oxazol-3-yl)methyl 1-(2-nitrophenyl)piperidine-4-carboxylate

Systemtic Name: (5-phenyl-1,2-oxazol-3-yl)methyl 1-(2-nitrophenyl)piperidine-4-carboxylate Openeye Name: (5-phenylisoxazol-3-yl)methyl 1-(2-nitrophenyl)piperidine-4-carboxylate CAS Name: 1-(2-nitrophenyl)-4-piperidinecarboxylic acid (5-phenyl-3-isoxazolyl)methyl ester IUPAC Name: (5-phenyl-1,2-oxazol-3-yl)methyl 1-(2-nitrophenyl)piperidine-4-carboxylate Traditional Name: 1-(2-nitrophenyl)isonipecotic acid (5-phenylisoxazol-3-yl)methyl ester Formula: C22H21N3O5 MolecularWeight: 407.41924

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OCC2=NOC(=C2)C3=CC=CC=C3)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C(=O)OCC2=NOC(=C2)C3=CC=CC=C3)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C22H21N3O5/c26-22(29-15-18-14-21(30-23-18)16-6-2-1-3-7-16)17-10-12-24(13-11-17)19-8-4-5-9-20(19)25(27)28/h1-9,14,17H,10-13,15H2