N-[4-(2-fluoranylphenoxy)phenyl]-1-[(E)-2-methylbut-2-enyl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-[4-(2-fluoranylphenoxy)phenyl]-1-[(E)-2-methylbut-2-enyl]piperidin-1-ium-4-carboxamide Openeye Name: N-[4-(2-fluorophenoxy)phenyl]-1-[(E)-2-methylbut-2-enyl]piperidin-1-ium-4-carboxamide CAS Name: N-[4-(2-fluorophenoxy)phenyl]-1-[(E)-2-methylbut-2-enyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-[4-(2-fluorophenoxy)phenyl]-1-[(E)-2-methylbut-2-enyl]piperidin-1-ium-4-carboxamide Traditional Name: N-[4-(2-fluorophenoxy)phenyl]-1-[(E)-2-methylbut-2-enyl]piperidin-1-ium-4-carboxamide Formula: C23H28FN2O2+ MolecularWeight: 383.479023

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Descriptors Computed from Structure

Canonical SMILES:

CC=C(C)C[NH+]1CCC(CC1)C(=O)NC2=CC=C(C=C2)OC3=CC=CC=C3F

Isomeric SMILES

C/C=C(\C)/C[NH+]1CCC(CC1)C(=O)NC2=CC=C(C=C2)OC3=CC=CC=C3F

InChI

InChI=1S/C23H27FN2O2/c1-3-17(2)16-26-14-12-18(13-15-26)23(27)25-19-8-10-20(11-9-19)28-22-7-5-4-6-21(22)24/h3-11,18H,12-16H2,1-2H3,(H,25,27)/p+1/b17-3+