2-[4-(naphthalen-1-ylmethyl)piperazin-1-ium-1-yl]-N-[(1R)-1-thiophen-2-ylethyl]ethanamide

Systemtic Name: 2-[4-(naphthalen-1-ylmethyl)piperazin-1-ium-1-yl]-N-[(1R)-1-thiophen-2-ylethyl]ethanamide Openeye Name: 2-[4-(1-naphthylmethyl)piperazin-1-ium-1-yl]-N-[(1R)-1-(2-thienyl)ethyl]acetamide CAS Name: 2-[4-(1-naphthalenylmethyl)-1-piperazin-1-iumyl]-N-[(1R)-1-thiophen-2-ylethyl]acetamide IUPAC Name: 2-[4-(naphthalen-1-ylmethyl)piperazin-1-ium-1-yl]-N-[(1R)-1-thiophen-2-ylethyl]acetamide Traditional Name: 2-[4-(1-naphthylmethyl)piperazin-1-ium-1-yl]-N-[(1R)-1-(2-thienyl)ethyl]acetamide Formula: C23H28N3OS+ MolecularWeight: 394.55292

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CS1)NC(=O)C[NH+]2CCN(CC2)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

C[C@H](C1=CC=CS1)NC(=O)C[NH+]2CCN(CC2)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C23H27N3OS/c1-18(22-10-5-15-28-22)24-23(27)17-26-13-11-25(12-14-26)16-20-8-4-7-19-6-2-3-9-21(19)20/h2-10,15,18H,11-14,16-17H2,1H3,(H,24,27)/p+1/t18-/m1/s1