ethyl 1-(2-fluorophenyl)sulfonyl-4-[(4-methoxyphenyl)methyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-(2-fluorophenyl)sulfonyl-4-[(4-methoxyphenyl)methyl]piperidine-4-carboxylate Openeye Name: ethyl 1-(2-fluorophenyl)sulfonyl-4-[(4-methoxyphenyl)methyl]piperidine-4-carboxylate CAS Name: 1-(2-fluorophenyl)sulfonyl-4-[(4-methoxyphenyl)methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-fluorophenyl)sulfonyl-4-[(4-methoxyphenyl)methyl]piperidine-4-carboxylate Traditional Name: 1-(2-fluorophenyl)sulfonyl-4-p-anisyl-isonipecotic acid ethyl ester Formula: C22H26FNO5S MolecularWeight: 435.508943

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)S(=O)(=O)C2=CC=CC=C2F)CC3=CC=C(C=C3)OC

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)S(=O)(=O)C2=CC=CC=C2F)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C22H26FNO5S/c1-3-29-21(25)22(16-17-8-10-18(28-2)11-9-17)12-14-24(15-13-22)30(26,27)20-7-5-4-6-19(20)23/h4-11H,3,12-16H2,1-2H3