N-(2,6-dimethylphenyl)-2-[4-(2-piperidin-1-ium-1-ylethanoyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(2,6-dimethylphenyl)-2-[4-(2-piperidin-1-ium-1-ylethanoyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(2,6-dimethylphenyl)-2-[4-(2-piperidin-1-ium-1-ylacetyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(2,6-dimethylphenyl)-2-[4-[1-oxo-2-(1-piperidin-1-iumyl)ethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(2,6-dimethylphenyl)-2-[4-(2-piperidin-1-ium-1-ylacetyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(2,6-dimethylphenyl)-2-[4-(2-piperidin-1-ium-1-ylacetyl)piperazin-1-ium-1-yl]acetamide Formula: C21H34N4O2+2 MolecularWeight: 374.52026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)C[NH+]2CCN(CC2)C(=O)C[NH+]3CCCCC3

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)C[NH+]2CCN(CC2)C(=O)C[NH+]3CCCCC3

InChI

InChI=1S/C21H32N4O2/c1-17-7-6-8-18(2)21(17)22-19(26)15-24-11-13-25(14-12-24)20(27)16-23-9-4-3-5-10-23/h6-8H,3-5,9-16H2,1-2H3,(H,22,26)/p+2