N-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-2-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]-N-methyl-ethanamide

Systemtic Name: N-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-2-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]-N-methyl-ethanamide Openeye Name: N-[2-(tert-butylamino)-2-oxo-ethyl]-2-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]-N-methyl-acetamide CAS Name: N-[2-(tert-butylamino)-2-oxoethyl]-2-[4-(3-methoxyphenyl)-1-piperazin-1-iumyl]-N-methylacetamide IUPAC Name: N-[2-(tert-butylamino)-2-oxoethyl]-2-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]-N-methylacetamide Traditional Name: N-[2-(tert-butylamino)-2-keto-ethyl]-2-[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]-N-methyl-acetamide Formula: C20H33N4O3+ MolecularWeight: 377.50102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CN(C)C(=O)C[NH+]1CCN(CC1)C2=CC(=CC=C2)OC

Isomeric SMILES

CC(C)(C)NC(=O)CN(C)C(=O)C[NH+]1CCN(CC1)C2=CC(=CC=C2)OC

InChI

InChI=1S/C20H32N4O3/c1-20(2,3)21-18(25)14-22(4)19(26)15-23-9-11-24(12-10-23)16-7-6-8-17(13-16)27-5/h6-8,13H,9-12,14-15H2,1-5H3,(H,21,25)/p+1