ethyl 1-[(3-nitro-4-oxidanyl-phenyl)methyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[(3-nitro-4-oxidanyl-phenyl)methyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[(4-hydroxy-3-nitro-phenyl)methyl]piperidine-4-carboxylate CAS Name: 1-[(4-hydroxy-3-nitrophenyl)methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(4-hydroxy-3-nitrophenyl)methyl]piperidine-4-carboxylate Traditional Name: 1-(4-hydroxy-3-nitro-benzyl)isonipecotic acid ethyl ester Formula: C15H20N2O5 MolecularWeight: 308.3297

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)CC2=CC(=C(C=C2)O)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1CCN(CC1)CC2=CC(=C(C=C2)O)[N+](=O)[O-]

InChI

InChI=1S/C15H20N2O5/c1-2-22-15(19)12-5-7-16(8-6-12)10-11-3-4-14(18)13(9-11)17(20)21/h3-4,9,12,18H,2,5-8,10H2,1H3