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

Systemtic Name: ethyl 1-[(4-aminocarbonyl-2-nitro-phenyl)methyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[(4-carbamoyl-2-nitro-phenyl)methyl]piperidine-4-carboxylate CAS Name: 1-[(4-carbamoyl-2-nitrophenyl)methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(4-carbamoyl-2-nitrophenyl)methyl]piperidine-4-carboxylate Traditional Name: 1-(4-carbamoyl-2-nitro-benzyl)isonipecotic acid ethyl ester Formula: C16H21N3O5 MolecularWeight: 335.35504

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21N3O5/c1-2-24-16(21)11-5-7-18(8-6-11)10-13-4-3-12(15(17)20)9-14(13)19(22)23/h3-4,9,11H,2,5-8,10H2,1H3,(H2,17,20)