N1-(3,5-dimethylphenyl)-4-piperidin-1-ium-1-yl-piperidine-1,4-dicarboxamide

Systemtic Name: N1-(3,5-dimethylphenyl)-4-piperidin-1-ium-1-yl-piperidine-1,4-dicarboxamide Openeye Name: N1-(3,5-dimethylphenyl)-4-piperidin-1-ium-1-yl-piperidine-1,4-dicarboxamide CAS Name: N1-(3,5-dimethylphenyl)-4-(1-piperidin-1-iumyl)piperidine-1,4-dicarboxamide IUPAC Name: 1-N-(3,5-dimethylphenyl)-4-piperidin-1-ium-1-ylpiperidine-1,4-dicarboxamide Traditional Name: N-(3,5-dimethylphenyl)-4-piperidin-1-ium-1-yl-piperidine-1,4-dicarboxamide Formula: C20H31N4O2+ MolecularWeight: 359.48574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)N2CCC(CC2)(C(=O)N)[NH+]3CCCCC3)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)N2CCC(CC2)(C(=O)N)[NH+]3CCCCC3)C

InChI

InChI=1S/C20H30N4O2/c1-15-12-16(2)14-17(13-15)22-19(26)23-10-6-20(7-11-23,18(21)25)24-8-4-3-5-9-24/h12-14H,3-11H2,1-2H3,(H2,21,25)(H,22,26)/p+1