N-[2-(4-fluorophenyl)ethyl]-4-[[4-[2-[[(2S)-2-oxidanyl-3-(4-oxidanylphenoxy)propyl]amino]ethyl]phenyl]amino]piperidine-1-carboxamide

Systemtic Name: N-[2-(4-fluorophenyl)ethyl]-4-[[4-[2-[[(2S)-2-oxidanyl-3-(4-oxidanylphenoxy)propyl]amino]ethyl]phenyl]amino]piperidine-1-carboxamide Openeye Name: N-[2-(4-fluorophenyl)ethyl]-4-[4-[2-[[(2S)-2-hydroxy-3-(4-hydroxyphenoxy)propyl]amino]ethyl]anilino]piperidine-1-carboxamide CAS Name: N-[2-(4-fluorophenyl)ethyl]-4-[4-[2-[[(2S)-2-hydroxy-3-(4-hydroxyphenoxy)propyl]amino]ethyl]anilino]-1-piperidinecarboxamide IUPAC Name: N-[2-(4-fluorophenyl)ethyl]-4-[4-[2-[[(2S)-2-hydroxy-3-(4-hydroxyphenoxy)propyl]amino]ethyl]anilino]piperidine-1-carboxamide Traditional Name: N-[2-(4-fluorophenyl)ethyl]-4-[4-[2-[[(2S)-2-hydroxy-3-(4-hydroxyphenoxy)propyl]amino]ethyl]anilino]piperidine-1-carboxamide Formula: C31H39FN4O4 MolecularWeight: 550.664163

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC2=CC=C(C=C2)CCNCC(COC3=CC=C(C=C3)O)O)C(=O)NCCC4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCC1NC2=CC=C(C=C2)CCNC[C@@H](COC3=CC=C(C=C3)O)O)C(=O)NCCC4=CC=C(C=C4)F

InChI

InChI=1S/C31H39FN4O4/c32-25-5-1-23(2-6-25)14-18-34-31(39)36-19-15-27(16-20-36)35-26-7-3-24(4-8-26)13-17-33-21-29(38)22-40-30-11-9-28(37)10-12-30/h1-12,27,29,33,35,37-38H,13-22H2,(H,34,39)/t29-/m0/s1