ethyl 1-[4-(4-nitrophenyl)phenyl]sulfonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[4-(4-nitrophenyl)phenyl]sulfonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[4-(4-nitrophenyl)phenyl]sulfonylpiperidine-4-carboxylate CAS Name: 1-[4-(4-nitrophenyl)phenyl]sulfonyl-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-(4-nitrophenyl)phenyl]sulfonylpiperidine-4-carboxylate Traditional Name: 1-[4-(4-nitrophenyl)phenyl]sulfonylisonipecotic acid ethyl ester Formula: C20H22N2O6S MolecularWeight: 418.46348

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N2O6S/c1-2-28-20(23)17-11-13-21(14-12-17)29(26,27)19-9-5-16(6-10-19)15-3-7-18(8-4-15)22(24)25/h3-10,17H,2,11-14H2,1H3