ethyl 1-[(2-chloranyl-5-nitro-phenyl)methyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[(2-chloranyl-5-nitro-phenyl)methyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[(2-chloro-5-nitro-phenyl)methyl]piperidine-4-carboxylate CAS Name: 1-[(2-chloro-5-nitrophenyl)methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(2-chloro-5-nitrophenyl)methyl]piperidine-4-carboxylate Traditional Name: 1-(2-chloro-5-nitro-benzyl)isonipecotic acid ethyl ester Formula: C15H19ClN2O4 MolecularWeight: 326.77536

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19ClN2O4/c1-2-22-15(19)11-5-7-17(8-6-11)10-12-9-13(18(20)21)3-4-14(12)16/h3-4,9,11H,2,5-8,10H2,1H3