N-[1-(4-ethoxy-3-methoxy-phenyl)ethyl]-1-(2-fluorophenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[1-(4-ethoxy-3-methoxy-phenyl)ethyl]-1-(2-fluorophenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[1-(4-ethoxy-3-methoxy-phenyl)ethyl]-1-(2-fluorophenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[1-(4-ethoxy-3-methoxyphenyl)ethyl]-1-(2-fluorophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[1-(4-ethoxy-3-methoxyphenyl)ethyl]-1-(2-fluorophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[1-(4-ethoxy-3-methoxy-phenyl)ethyl]-1-(2-fluorophenyl)sulfonyl-isonipecotamide Formula: C23H29FN2O5S MolecularWeight: 464.550163

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3F)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(C)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3F)OC

InChI

InChI=1S/C23H29FN2O5S/c1-4-31-20-10-9-18(15-21(20)30-3)16(2)25-23(27)17-11-13-26(14-12-17)32(28,29)22-8-6-5-7-19(22)24/h5-10,15-17H,4,11-14H2,1-3H3,(H,25,27)