(7-methoxynaphthalen-2-yl) 1-[3-(trifluoromethyl)phenyl]sulfonylpiperidine-4-carboxylate

Systemtic Name: (7-methoxynaphthalen-2-yl) 1-[3-(trifluoromethyl)phenyl]sulfonylpiperidine-4-carboxylate Openeye Name: (7-methoxy-2-naphthyl) 1-[3-(trifluoromethyl)phenyl]sulfonylpiperidine-4-carboxylate CAS Name: 1-[3-(trifluoromethyl)phenyl]sulfonyl-4-piperidinecarboxylic acid (7-methoxy-2-naphthalenyl) ester IUPAC Name: (7-methoxynaphthalen-2-yl) 1-[3-(trifluoromethyl)phenyl]sulfonylpiperidine-4-carboxylate Traditional Name: 1-[3-(trifluoromethyl)phenyl]sulfonylisonipecotic acid (7-methoxy-2-naphthyl) ester Formula: C24H22F3NO5S MolecularWeight: 493.49539

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=CC(=C2)OC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

COC1=CC2=C(C=C1)C=CC(=C2)OC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C24H22F3NO5S/c1-32-20-7-5-16-6-8-21(14-18(16)13-20)33-23(29)17-9-11-28(12-10-17)34(30,31)22-4-2-3-19(15-22)24(25,26)27/h2-8,13-15,17H,9-12H2,1H3