2-(4-cyclopropylcarbonylpiperazin-1-ium-1-yl)-N-(2,4-dimethylphenyl)ethanamide

Systemtic Name: 2-(4-cyclopropylcarbonylpiperazin-1-ium-1-yl)-N-(2,4-dimethylphenyl)ethanamide Openeye Name: 2-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]-N-(2,4-dimethylphenyl)acetamide CAS Name: 2-[4-[cyclopropyl(oxo)methyl]-1-piperazin-1-iumyl]-N-(2,4-dimethylphenyl)acetamide IUPAC Name: 2-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]-N-(2,4-dimethylphenyl)acetamide Traditional Name: 2-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]-N-(2,4-dimethylphenyl)acetamide Formula: C18H26N3O2+ MolecularWeight: 316.41794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C[NH+]2CCN(CC2)C(=O)C3CC3)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C[NH+]2CCN(CC2)C(=O)C3CC3)C

InChI

InChI=1S/C18H25N3O2/c1-13-3-6-16(14(2)11-13)19-17(22)12-20-7-9-21(10-8-20)18(23)15-4-5-15/h3,6,11,15H,4-5,7-10,12H2,1-2H3,(H,19,22)/p+1