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

Systemtic Name: N-(2,3-dimethylphenyl)-2-[2-[4-(phenylmethyl)piperidin-1-ium-1-yl]ethanoylamino]ethanamide Openeye Name: 2-[[2-(4-benzylpiperidin-1-ium-1-yl)acetyl]amino]-N-(2,3-dimethylphenyl)acetamide CAS Name: N-(2,3-dimethylphenyl)-2-[[1-oxo-2-[4-(phenylmethyl)-1-piperidin-1-iumyl]ethyl]amino]acetamide IUPAC Name: 2-[[2-(4-benzylpiperidin-1-ium-1-yl)acetyl]amino]-N-(2,3-dimethylphenyl)acetamide Traditional Name: 2-[[2-(4-benzylpiperidin-1-ium-1-yl)acetyl]amino]-N-(2,3-dimethylphenyl)acetamide Formula: C24H32N3O2+ MolecularWeight: 394.52978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)CNC(=O)C[NH+]2CCC(CC2)CC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)CNC(=O)C[NH+]2CCC(CC2)CC3=CC=CC=C3)C

InChI

InChI=1S/C24H31N3O2/c1-18-7-6-10-22(19(18)2)26-23(28)16-25-24(29)17-27-13-11-21(12-14-27)15-20-8-4-3-5-9-20/h3-10,21H,11-17H2,1-2H3,(H,25,29)(H,26,28)/p+1