2-[3-[5-[cyclohexyl(phenyl)methyl]-1H-pyrazol-3-yl]pyridin-1-ium-1-yl]-N-cyclopropyl-ethanamide

Systemtic Name: 2-[3-[5-[cyclohexyl(phenyl)methyl]-1H-pyrazol-3-yl]pyridin-1-ium-1-yl]-N-cyclopropyl-ethanamide Openeye Name: 2-[3-[5-[cyclohexyl(phenyl)methyl]-1H-pyrazol-3-yl]pyridin-1-ium-1-yl]-N-cyclopropyl-acetamide CAS Name: 2-[3-[5-[cyclohexyl(phenyl)methyl]-1H-pyrazol-3-yl]-1-pyridin-1-iumyl]-N-cyclopropylacetamide IUPAC Name: 2-[3-[5-[cyclohexyl(phenyl)methyl]-1H-pyrazol-3-yl]pyridin-1-ium-1-yl]-N-cyclopropylacetamide Traditional Name: 2-[3-[5-[cyclohexyl(phenyl)methyl]-1H-pyrazol-3-yl]pyridin-1-ium-1-yl]-N-cyclopropyl-acetamide Formula: C26H31N4O+ MolecularWeight: 415.55054

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(C2=CC=CC=C2)C3=CC(=NN3)C4=C[N+](=CC=C4)CC(=O)NC5CC5

Isomeric SMILES

C1CCC(CC1)C(C2=CC=CC=C2)C3=CC(=NN3)C4=C[N+](=CC=C4)CC(=O)NC5CC5

InChI

InChI=1S/C26H30N4O/c31-25(27-22-13-14-22)18-30-15-7-12-21(17-30)23-16-24(29-28-23)26(19-8-3-1-4-9-19)20-10-5-2-6-11-20/h1,3-4,7-9,12,15-17,20,22,26H,2,5-6,10-11,13-14,18H2,(H-,27,28,29,31)/p+1