2-(2,5-dimethylphenyl)-5-(3-methoxyphenyl)-N-(2-pyrrolidin-1-ium-1-ylethyl)pyrazole-3-carboxamide

Systemtic Name: 2-(2,5-dimethylphenyl)-5-(3-methoxyphenyl)-N-(2-pyrrolidin-1-ium-1-ylethyl)pyrazole-3-carboxamide Openeye Name: 2-(2,5-dimethylphenyl)-5-(3-methoxyphenyl)-N-(2-pyrrolidin-1-ium-1-ylethyl)pyrazole-3-carboxamide CAS Name: 2-(2,5-dimethylphenyl)-5-(3-methoxyphenyl)-N-[2-(1-pyrrolidin-1-iumyl)ethyl]-3-pyrazolecarboxamide IUPAC Name: 2-(2,5-dimethylphenyl)-5-(3-methoxyphenyl)-N-(2-pyrrolidin-1-ium-1-ylethyl)pyrazole-3-carboxamide Traditional Name: 2-(2,5-dimethylphenyl)-5-(3-methoxyphenyl)-N-(2-pyrrolidin-1-ium-1-ylethyl)pyrazole-3-carboxamide Formula: C25H31N4O2+ MolecularWeight: 419.53924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2C(=CC(=N2)C3=CC(=CC=C3)OC)C(=O)NCC[NH+]4CCCC4

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2C(=CC(=N2)C3=CC(=CC=C3)OC)C(=O)NCC[NH+]4CCCC4

InChI

InChI=1S/C25H30N4O2/c1-18-9-10-19(2)23(15-18)29-24(25(30)26-11-14-28-12-4-5-13-28)17-22(27-29)20-7-6-8-21(16-20)31-3/h6-10,15-17H,4-5,11-14H2,1-3H3,(H,26,30)/p+1