N-[5-methyl-2-(2-methylphenyl)pyrazol-3-yl]-2-pyrrolidin-1-ium-1-yl-ethanamide

Systemtic Name: N-[5-methyl-2-(2-methylphenyl)pyrazol-3-yl]-2-pyrrolidin-1-ium-1-yl-ethanamide Openeye Name: N-[5-methyl-2-(o-tolyl)pyrazol-3-yl]-2-pyrrolidin-1-ium-1-yl-acetamide CAS Name: N-[5-methyl-2-(2-methylphenyl)-3-pyrazolyl]-2-(1-pyrrolidin-1-iumyl)acetamide IUPAC Name: N-[5-methyl-2-(2-methylphenyl)pyrazol-3-yl]-2-pyrrolidin-1-ium-1-ylacetamide Traditional Name: N-[5-methyl-2-(o-tolyl)pyrazol-3-yl]-2-pyrrolidin-1-ium-1-yl-acetamide Formula: C17H23N4O+ MolecularWeight: 299.39072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=CC(=N2)C)NC(=O)C[NH+]3CCCC3

Isomeric SMILES

CC1=CC=CC=C1N2C(=CC(=N2)C)NC(=O)C[NH+]3CCCC3

InChI

InChI=1S/C17H22N4O/c1-13-7-3-4-8-15(13)21-16(11-14(2)19-21)18-17(22)12-20-9-5-6-10-20/h3-4,7-8,11H,5-6,9-10,12H2,1-2H3,(H,18,22)/p+1