2-[4-[(3,5-dimethylphenyl)carbamoylamino]piperidin-1-ium-1-yl]-N-(2,4,6-trimethylphenyl)ethanamide

Systemtic Name: 2-[4-[(3,5-dimethylphenyl)carbamoylamino]piperidin-1-ium-1-yl]-N-(2,4,6-trimethylphenyl)ethanamide Openeye Name: 2-[4-[(3,5-dimethylphenyl)carbamoylamino]piperidin-1-ium-1-yl]-N-(2,4,6-trimethylphenyl)acetamide CAS Name: 2-[4-[[(3,5-dimethylanilino)-oxomethyl]amino]-1-piperidin-1-iumyl]-N-(2,4,6-trimethylphenyl)acetamide IUPAC Name: 2-[4-[(3,5-dimethylphenyl)carbamoylamino]piperidin-1-ium-1-yl]-N-(2,4,6-trimethylphenyl)acetamide Traditional Name: 2-[4-[(3,5-dimethylphenyl)carbamoylamino]piperidin-1-ium-1-yl]-N-mesityl-acetamide Formula: C25H35N4O2+ MolecularWeight: 423.571

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)NC2CC[NH+](CC2)CC(=O)NC3=C(C=C(C=C3C)C)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)NC2CC[NH+](CC2)CC(=O)NC3=C(C=C(C=C3C)C)C)C

InChI

InChI=1S/C25H34N4O2/c1-16-10-17(2)14-22(13-16)27-25(31)26-21-6-8-29(9-7-21)15-23(30)28-24-19(4)11-18(3)12-20(24)5/h10-14,21H,6-9,15H2,1-5H3,(H,28,30)(H2,26,27,31)/p+1