N-(4-methylphenyl)-2-[4-[2-[(3R)-3-methylpiperidin-1-ium-1-yl]ethanoyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(4-methylphenyl)-2-[4-[2-[(3R)-3-methylpiperidin-1-ium-1-yl]ethanoyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: 2-[4-[2-[(3R)-3-methylpiperidin-1-ium-1-yl]acetyl]piperazin-1-ium-1-yl]-N-(p-tolyl)acetamide CAS Name: N-(4-methylphenyl)-2-[4-[2-[(3R)-3-methyl-1-piperidin-1-iumyl]-1-oxoethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(4-methylphenyl)-2-[4-[2-[(3R)-3-methylpiperidin-1-ium-1-yl]acetyl]piperazin-1-ium-1-yl]acetamide Traditional Name: 2-[4-[2-[(3R)-3-methylpiperidin-1-ium-1-yl]acetyl]piperazin-1-ium-1-yl]-N-(p-tolyl)acetamide Formula: C21H34N4O2+2 MolecularWeight: 374.52026

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CC(=O)N2CC[NH+](CC2)CC(=O)NC3=CC=C(C=C3)C

Isomeric SMILES

C[C@@H]1CCC[NH+](C1)CC(=O)N2CC[NH+](CC2)CC(=O)NC3=CC=C(C=C3)C

InChI

InChI=1S/C21H32N4O2/c1-17-5-7-19(8-6-17)22-20(26)15-23-10-12-25(13-11-23)21(27)16-24-9-3-4-18(2)14-24/h5-8,18H,3-4,9-16H2,1-2H3,(H,22,26)/p+2/t18-/m1/s1