N-[3,5-dimethyl-1-(4-methylphenyl)pyrazol-4-yl]-2-pyrrolidin-1-ium-1-yl-ethanamide

Systemtic Name: N-[3,5-dimethyl-1-(4-methylphenyl)pyrazol-4-yl]-2-pyrrolidin-1-ium-1-yl-ethanamide Openeye Name: N-[3,5-dimethyl-1-(p-tolyl)pyrazol-4-yl]-2-pyrrolidin-1-ium-1-yl-acetamide CAS Name: N-[3,5-dimethyl-1-(4-methylphenyl)-4-pyrazolyl]-2-(1-pyrrolidin-1-iumyl)acetamide IUPAC Name: N-[3,5-dimethyl-1-(4-methylphenyl)pyrazol-4-yl]-2-pyrrolidin-1-ium-1-ylacetamide Traditional Name: N-[3,5-dimethyl-1-(p-tolyl)pyrazol-4-yl]-2-pyrrolidin-1-ium-1-yl-acetamide Formula: C18H25N4O+ MolecularWeight: 313.4173

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C(C(=N2)C)NC(=O)C[NH+]3CCCC3)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C(C(=N2)C)NC(=O)C[NH+]3CCCC3)C

InChI

InChI=1S/C18H24N4O/c1-13-6-8-16(9-7-13)22-15(3)18(14(2)20-22)19-17(23)12-21-10-4-5-11-21/h6-9H,4-5,10-12H2,1-3H3,(H,19,23)/p+1