ethyl 1-[2-nitro-5-[4-(phenylcarbonyl)phenoxy]phenyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-nitro-5-[4-(phenylcarbonyl)phenoxy]phenyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[5-(4-benzoylphenoxy)-2-nitro-phenyl]piperidine-4-carboxylate CAS Name: 1-[5-(4-benzoylphenoxy)-2-nitrophenyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[5-(4-benzoylphenoxy)-2-nitrophenyl]piperidine-4-carboxylate Traditional Name: 1-[5-(4-benzoylphenoxy)-2-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=C(C=CC(=C2)OC3=CC=C(C=C3)C(=O)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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