1-(3-chloranyl-4-ethoxy-phenyl)sulfonyl-N-[(4-fluorophenyl)methyl]piperidine-4-carboxamide

Systemtic Name: 1-(3-chloranyl-4-ethoxy-phenyl)sulfonyl-N-[(4-fluorophenyl)methyl]piperidine-4-carboxamide Openeye Name: 1-(3-chloro-4-ethoxy-phenyl)sulfonyl-N-[(4-fluorophenyl)methyl]piperidine-4-carboxamide CAS Name: 1-(3-chloro-4-ethoxyphenyl)sulfonyl-N-[(4-fluorophenyl)methyl]-4-piperidinecarboxamide IUPAC Name: 1-(3-chloro-4-ethoxyphenyl)sulfonyl-N-[(4-fluorophenyl)methyl]piperidine-4-carboxamide Traditional Name: 1-(3-chloro-4-ethoxy-phenyl)sulfonyl-N-(4-fluorobenzyl)isonipecotamide Formula: C21H24ClFN2O4S MolecularWeight: 454.942663

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC=C(C=C3)F)Cl

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC=C(C=C3)F)Cl

InChI

InChI=1S/C21H24ClFN2O4S/c1-2-29-20-8-7-18(13-19(20)22)30(27,28)25-11-9-16(10-12-25)21(26)24-14-15-3-5-17(23)6-4-15/h3-8,13,16H,2,9-12,14H2,1H3,(H,24,26)