N-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]-3,4,5-trimethoxy-N-methyl-benzamide

Systemtic Name: N-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]-3,4,5-trimethoxy-N-methyl-benzamide Openeye Name: N-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]-3,4,5-trimethoxy-N-methyl-benzamide CAS Name: N-[(3S)-1-[(2-fluorophenyl)methyl]-3-piperidin-1-iumyl]-3,4,5-trimethoxy-N-methylbenzamide IUPAC Name: N-[(3S)-1-[(2-fluorophenyl)methyl]piperidin-1-ium-3-yl]-3,4,5-trimethoxy-N-methylbenzamide Traditional Name: N-[(3S)-1-(2-fluorobenzyl)piperidin-1-ium-3-yl]-3,4,5-trimethoxy-N-methyl-benzamide Formula: C23H30FN2O4+ MolecularWeight: 417.493703

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCC[NH+](C1)CC2=CC=CC=C2F)C(=O)C3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

CN([C@H]1CCC[NH+](C1)CC2=CC=CC=C2F)C(=O)C3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C23H29FN2O4/c1-25(23(27)17-12-20(28-2)22(30-4)21(13-17)29-3)18-9-7-11-26(15-18)14-16-8-5-6-10-19(16)24/h5-6,8,10,12-13,18H,7,9,11,14-15H2,1-4H3/p+1/t18-/m0/s1