methyl 1-(3-fluoranyl-4-methoxy-phenyl)sulfonyl-4-phenyl-piperidine-4-carboxylate

Systemtic Name: methyl 1-(3-fluoranyl-4-methoxy-phenyl)sulfonyl-4-phenyl-piperidine-4-carboxylate Openeye Name: methyl 1-(3-fluoro-4-methoxy-phenyl)sulfonyl-4-phenyl-piperidine-4-carboxylate CAS Name: 1-(3-fluoro-4-methoxyphenyl)sulfonyl-4-phenyl-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(3-fluoro-4-methoxyphenyl)sulfonyl-4-phenylpiperidine-4-carboxylate Traditional Name: 1-(3-fluoro-4-methoxy-phenyl)sulfonyl-4-phenyl-isonipecotic acid methyl ester Formula: C20H22FNO5S MolecularWeight: 407.455783

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)(C3=CC=CC=C3)C(=O)OC)F

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)(C3=CC=CC=C3)C(=O)OC)F

InChI

InChI=1S/C20H22FNO5S/c1-26-18-9-8-16(14-17(18)21)28(24,25)22-12-10-20(11-13-22,19(23)27-2)15-6-4-3-5-7-15/h3-9,14H,10-13H2,1-2H3