ethyl 1-[6-(4-cyclopentylphenoxy)-3-nitro-pyridin-2-yl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[6-(4-cyclopentylphenoxy)-3-nitro-pyridin-2-yl]piperidine-4-carboxylate Openeye Name: ethyl 1-[6-(4-cyclopentylphenoxy)-3-nitro-2-pyridyl]piperidine-4-carboxylate CAS Name: 1-[6-(4-cyclopentylphenoxy)-3-nitro-2-pyridinyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[6-(4-cyclopentylphenoxy)-3-nitropyridin-2-yl]piperidine-4-carboxylate Traditional Name: 1-[6-(4-cyclopentylphenoxy)-3-nitro-2-pyridyl]isonipecotic acid ethyl ester Formula: C24H29N3O5 MolecularWeight: 439.50416

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C2=C(C=CC(=N2)OC3=CC=C(C=C3)C4CCCC4)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2=C(C=CC(=N2)OC3=CC=C(C=C3)C4CCCC4)[N+](=O)[O-]

InChI

InChI=1S/C24H29N3O5/c1-2-31-24(28)19-13-15-26(16-14-19)23-21(27(29)30)11-12-22(25-23)32-20-9-7-18(8-10-20)17-5-3-4-6-17/h7-12,17,19H,2-6,13-16H2,1H3