(2R)-N-(4-methoxyphenyl)-2-[4-(thiophen-2-ylmethyl)piperazin-1-ium-1-yl]propanamide

Systemtic Name: (2R)-N-(4-methoxyphenyl)-2-[4-(thiophen-2-ylmethyl)piperazin-1-ium-1-yl]propanamide Openeye Name: (2R)-N-(4-methoxyphenyl)-2-[4-(2-thienylmethyl)piperazin-1-ium-1-yl]propanamide CAS Name: (2R)-N-(4-methoxyphenyl)-2-[4-(thiophen-2-ylmethyl)-1-piperazin-1-iumyl]propanamide IUPAC Name: (2R)-N-(4-methoxyphenyl)-2-[4-(thiophen-2-ylmethyl)piperazin-1-ium-1-yl]propanamide Traditional Name: (2R)-N-(4-methoxyphenyl)-2-[4-(2-thenyl)piperazin-1-ium-1-yl]propionamide Formula: C19H26N3O2S+ MolecularWeight: 360.49364

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)OC)[NH+]2CCN(CC2)CC3=CC=CS3

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)OC)[NH+]2CCN(CC2)CC3=CC=CS3

InChI

InChI=1S/C19H25N3O2S/c1-15(19(23)20-16-5-7-17(24-2)8-6-16)22-11-9-21(10-12-22)14-18-4-3-13-25-18/h3-8,13,15H,9-12,14H2,1-2H3,(H,20,23)/p+1/t15-/m1/s1