N-phenethyl-3-[1-(thiophen-2-ylmethyl)piperidin-1-ium-4-yl]oxy-benzamide

Systemtic Name: N-phenethyl-3-[1-(thiophen-2-ylmethyl)piperidin-1-ium-4-yl]oxy-benzamide Openeye Name: N-phenethyl-3-[1-(2-thienylmethyl)piperidin-1-ium-4-yl]oxy-benzamide CAS Name: N-phenethyl-3-[[1-(thiophen-2-ylmethyl)-4-piperidin-1-iumyl]oxy]benzamide IUPAC Name: N-phenethyl-3-[1-(thiophen-2-ylmethyl)piperidin-1-ium-4-yl]oxybenzamide Traditional Name: N-phenethyl-3-[1-(2-thenyl)piperidin-1-ium-4-yl]oxy-benzamide Formula: C25H29N2O2S+ MolecularWeight: 421.57496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1OC2=CC=CC(=C2)C(=O)NCCC3=CC=CC=C3)CC4=CC=CS4

Isomeric SMILES

C1C[NH+](CCC1OC2=CC=CC(=C2)C(=O)NCCC3=CC=CC=C3)CC4=CC=CS4

InChI

InChI=1S/C25H28N2O2S/c28-25(26-14-11-20-6-2-1-3-7-20)21-8-4-9-23(18-21)29-22-12-15-27(16-13-22)19-24-10-5-17-30-24/h1-10,17-18,22H,11-16,19H2,(H,26,28)/p+1