ethyl 1-[4-nitro-3-[4-(phenylcarbonyl)phenoxy]phenyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[4-nitro-3-[4-(phenylcarbonyl)phenoxy]phenyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[3-(4-benzoylphenoxy)-4-nitro-phenyl]piperidine-4-carboxylate CAS Name: 1-[3-(4-benzoylphenoxy)-4-nitrophenyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-(4-benzoylphenoxy)-4-nitrophenyl]piperidine-4-carboxylate Traditional Name: 1-[3-(4-benzoylphenoxy)-4-nitro-phenyl]isonipecotic acid ethyl ester Formula: C27H26N2O6 MolecularWeight: 474.50514

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C2=CC(=C(C=C2)[N+](=O)[O-])OC3=CC=C(C=C3)C(=O)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2=CC(=C(C=C2)[N+](=O)[O-])OC3=CC=C(C=C3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H26N2O6/c1-2-34-27(31)21-14-16-28(17-15-21)22-10-13-24(29(32)33)25(18-22)35-23-11-8-20(9-12-23)26(30)19-6-4-3-5-7-19/h3-13,18,21H,2,14-17H2,1H3