2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]-N-[(2R)-5-methylhexan-2-yl]ethanamide

Systemtic Name: 2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]-N-[(2R)-5-methylhexan-2-yl]ethanamide Openeye Name: N-[(1R)-1,4-dimethylpentyl]-2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]acetamide CAS Name: 2-[4-(2-ethoxyphenyl)-1-piperazin-1-iumyl]-N-[(2R)-5-methylhexan-2-yl]acetamide IUPAC Name: 2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]-N-[(2R)-5-methylhexan-2-yl]acetamide Traditional Name: N-[(1R)-1,4-dimethylpentyl]-2-(4-o-phenetylpiperazin-1-ium-1-yl)acetamide Formula: C21H36N3O2+ MolecularWeight: 362.52944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CC[NH+](CC2)CC(=O)NC(C)CCC(C)C

Isomeric SMILES

CCOC1=CC=CC=C1N2CC[NH+](CC2)CC(=O)N[C@H](C)CCC(C)C

InChI

InChI=1S/C21H35N3O2/c1-5-26-20-9-7-6-8-19(20)24-14-12-23(13-15-24)16-21(25)22-18(4)11-10-17(2)3/h6-9,17-18H,5,10-16H2,1-4H3,(H,22,25)/p+1/t18-/m1/s1