N-[4-(2-fluoranylphenoxy)phenyl]-1-(3-methylbut-2-enyl)piperidin-1-ium-4-carboxamide

Systemtic Name: N-[4-(2-fluoranylphenoxy)phenyl]-1-(3-methylbut-2-enyl)piperidin-1-ium-4-carboxamide Openeye Name: N-[4-(2-fluorophenoxy)phenyl]-1-(3-methylbut-2-enyl)piperidin-1-ium-4-carboxamide CAS Name: N-[4-(2-fluorophenoxy)phenyl]-1-(3-methylbut-2-enyl)-4-piperidin-1-iumcarboxamide IUPAC Name: N-[4-(2-fluorophenoxy)phenyl]-1-(3-methylbut-2-enyl)piperidin-1-ium-4-carboxamide Traditional Name: N-[4-(2-fluorophenoxy)phenyl]-1-(3-methylbut-2-enyl)piperidin-1-ium-4-carboxamide Formula: C23H28FN2O2+ MolecularWeight: 383.479023

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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