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

Systemtic Name: 2-[4-[(3,5-dimethylphenyl)carbamoylamino]piperidin-1-ium-1-yl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[4-[(3,5-dimethylphenyl)carbamoylamino]piperidin-1-ium-1-yl]acetamide CAS Name: 2-[4-[[(3,5-dimethylanilino)-oxomethyl]amino]-1-piperidin-1-iumyl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[4-[(3,5-dimethylphenyl)carbamoylamino]piperidin-1-ium-1-yl]acetamide Traditional Name: N-benzyl-2-[4-[(3,5-dimethylphenyl)carbamoylamino]piperidin-1-ium-1-yl]acetamide Formula: C23H31N4O2+ MolecularWeight: 395.51784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)NC2CC[NH+](CC2)CC(=O)NCC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)NC2CC[NH+](CC2)CC(=O)NCC3=CC=CC=C3)C

InChI

InChI=1S/C23H30N4O2/c1-17-12-18(2)14-21(13-17)26-23(29)25-20-8-10-27(11-9-20)16-22(28)24-15-19-6-4-3-5-7-19/h3-7,12-14,20H,8-11,15-16H2,1-2H3,(H,24,28)(H2,25,26,29)/p+1