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

Systemtic Name: N-[(1R,2R)-1-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-1-thiophen-2-yl-propan-2-yl]-2,2-dimethyl-propanamide Openeye Name: N-[(1R,2R)-2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-1-methyl-2-(2-thienyl)ethyl]-2,2-dimethyl-propanamide CAS Name: N-[(1R,2R)-1-[4-(2-methoxyphenyl)-1-piperazin-1-iumyl]-1-thiophen-2-ylpropan-2-yl]-2,2-dimethylpropanamide IUPAC Name: N-[(1R,2R)-1-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-1-thiophen-2-ylpropan-2-yl]-2,2-dimethylpropanamide Traditional Name: N-[(1R,2R)-2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-1-methyl-2-(2-thienyl)ethyl]-2,2-dimethyl-propionamide Formula: C23H34N3O2S+ MolecularWeight: 416.59996

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CS1)[NH+]2CCN(CC2)C3=CC=CC=C3OC)NC(=O)C(C)(C)C

Isomeric SMILES

C[C@H]([C@H](C1=CC=CS1)[NH+]2CCN(CC2)C3=CC=CC=C3OC)NC(=O)C(C)(C)C

InChI

InChI=1S/C23H33N3O2S/c1-17(24-22(27)23(2,3)4)21(20-11-8-16-29-20)26-14-12-25(13-15-26)18-9-6-7-10-19(18)28-5/h6-11,16-17,21H,12-15H2,1-5H3,(H,24,27)/p+1/t17-,21-/m1/s1