N-[(2R)-2-(4-ethoxy-3-methoxy-phenyl)-2-morpholin-4-ium-4-yl-ethyl]thiophene-3-carboxamide

Systemtic Name: N-[(2R)-2-(4-ethoxy-3-methoxy-phenyl)-2-morpholin-4-ium-4-yl-ethyl]thiophene-3-carboxamide Openeye Name: N-[(2R)-2-(4-ethoxy-3-methoxy-phenyl)-2-morpholin-4-ium-4-yl-ethyl]thiophene-3-carboxamide CAS Name: N-[(2R)-2-(4-ethoxy-3-methoxyphenyl)-2-(4-morpholin-4-iumyl)ethyl]-3-thiophenecarboxamide IUPAC Name: N-[(2R)-2-(4-ethoxy-3-methoxyphenyl)-2-morpholin-4-ium-4-ylethyl]thiophene-3-carboxamide Traditional Name: N-[(2R)-2-(4-ethoxy-3-methoxy-phenyl)-2-morpholin-4-ium-4-yl-ethyl]thiophene-3-carboxamide Formula: C20H27N2O4S+ MolecularWeight: 391.50438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(CNC(=O)C2=CSC=C2)[NH+]3CCOCC3)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)[C@H](CNC(=O)C2=CSC=C2)[NH+]3CCOCC3)OC

InChI

InChI=1S/C20H26N2O4S/c1-3-26-18-5-4-15(12-19(18)24-2)17(22-7-9-25-10-8-22)13-21-20(23)16-6-11-27-14-16/h4-6,11-12,14,17H,3,7-10,13H2,1-2H3,(H,21,23)/p+1/t17-/m0/s1