1-[(3-ethoxy-2-oxidanyl-phenyl)methyl]-N-[3-(3-fluorophenyl)phenyl]piperidine-4-carboxamide

Systemtic Name: 1-[(3-ethoxy-2-oxidanyl-phenyl)methyl]-N-[3-(3-fluorophenyl)phenyl]piperidine-4-carboxamide Openeye Name: 1-[(3-ethoxy-2-hydroxy-phenyl)methyl]-N-[3-(3-fluorophenyl)phenyl]piperidine-4-carboxamide CAS Name: 1-[(3-ethoxy-2-hydroxyphenyl)methyl]-N-[3-(3-fluorophenyl)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-[(3-ethoxy-2-hydroxyphenyl)methyl]-N-[3-(3-fluorophenyl)phenyl]piperidine-4-carboxamide Traditional Name: 1-(3-ethoxy-2-hydroxy-benzyl)-N-[3-(3-fluorophenyl)phenyl]isonipecotamide Formula: C27H29FN2O3 MolecularWeight: 448.529163

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1O)CN2CCC(CC2)C(=O)NC3=CC=CC(=C3)C4=CC(=CC=C4)F

Isomeric SMILES

CCOC1=CC=CC(=C1O)CN2CCC(CC2)C(=O)NC3=CC=CC(=C3)C4=CC(=CC=C4)F

InChI

InChI=1S/C27H29FN2O3/c1-2-33-25-11-5-8-22(26(25)31)18-30-14-12-19(13-15-30)27(32)29-24-10-4-7-21(17-24)20-6-3-9-23(28)16-20/h3-11,16-17,19,31H,2,12-15,18H2,1H3,(H,29,32)