N-(tert-butylcarbamoyl)-2-[4-(2,2-diphenylethanoyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(tert-butylcarbamoyl)-2-[4-(2,2-diphenylethanoyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(tert-butylcarbamoyl)-2-[4-(2,2-diphenylacetyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-[(tert-butylamino)-oxomethyl]-2-[4-(1-oxo-2,2-diphenylethyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(tert-butylcarbamoyl)-2-[4-(2,2-diphenylacetyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(tert-butylcarbamoyl)-2-[4-(2,2-diphenylacetyl)piperazin-1-ium-1-yl]acetamide Formula: C25H33N4O3+ MolecularWeight: 437.55452

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)NC(=O)C[NH+]1CCN(CC1)C(=O)C(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)NC(=O)NC(=O)C[NH+]1CCN(CC1)C(=O)C(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C25H32N4O3/c1-25(2,3)27-24(32)26-21(30)18-28-14-16-29(17-15-28)23(31)22(19-10-6-4-7-11-19)20-12-8-5-9-13-20/h4-13,22H,14-18H2,1-3H3,(H2,26,27,30,32)/p+1