N-[4-(methoxymethyl)-1-(2-thiophen-2-ylethyl)piperidin-1-ium-4-yl]-N-phenyl-propanamide

Systemtic Name: N-[4-(methoxymethyl)-1-(2-thiophen-2-ylethyl)piperidin-1-ium-4-yl]-N-phenyl-propanamide Openeye Name: N-[4-(methoxymethyl)-1-[2-(2-thienyl)ethyl]piperidin-1-ium-4-yl]-N-phenyl-propanamide CAS Name: N-[4-(methoxymethyl)-1-(2-thiophen-2-ylethyl)-4-piperidin-1-iumyl]-N-phenylpropanamide IUPAC Name: N-[4-(methoxymethyl)-1-(2-thiophen-2-ylethyl)piperidin-1-ium-4-yl]-N-phenylpropanamide Traditional Name: N-[4-(methoxymethyl)-1-[2-(2-thienyl)ethyl]piperidin-1-ium-4-yl]-N-phenyl-propionamide Formula: C22H31N2O2S+ MolecularWeight: 387.55874

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(C1=CC=CC=C1)C2(CC[NH+](CC2)CCC3=CC=CS3)COC

Isomeric SMILES

CCC(=O)N(C1=CC=CC=C1)C2(CC[NH+](CC2)CCC3=CC=CS3)COC

InChI

InChI=1S/C22H30N2O2S/c1-3-21(25)24(19-8-5-4-6-9-19)22(18-26-2)12-15-23(16-13-22)14-11-20-10-7-17-27-20/h4-10,17H,3,11-16,18H2,1-2H3/p+1