(3-fluorophenyl)methyl-[2-[(3R)-3-(furan-2-yl)-5-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: (3-fluorophenyl)methyl-[2-[(3R)-3-(furan-2-yl)-5-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: (3-fluorophenyl)methyl-[2-[(3R)-3-(2-furyl)-5-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-2-oxo-ethyl]-methyl-ammonium CAS Name: (3-fluorophenyl)methyl-[2-[(3R)-3-(2-furanyl)-5-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-2-oxoethyl]-methylammonium IUPAC Name: (3-fluorophenyl)methyl-[2-[(3R)-3-(furan-2-yl)-5-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]-2-oxoethyl]-methylazanium Traditional Name: (3-fluorobenzyl)-[2-[(5R)-5-(2-furyl)-3-(4-methoxyphenyl)-2-pyrazolin-1-yl]-2-keto-ethyl]-methyl-ammonium Formula: C24H25FN3O3+ MolecularWeight: 422.472003

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC(=CC=C1)F)CC(=O)N2C(CC(=N2)C3=CC=C(C=C3)OC)C4=CC=CO4

Isomeric SMILES

C[NH+](CC1=CC(=CC=C1)F)CC(=O)N2[C@H](CC(=N2)C3=CC=C(C=C3)OC)C4=CC=CO4

InChI

InChI=1S/C24H24FN3O3/c1-27(15-17-5-3-6-19(25)13-17)16-24(29)28-22(23-7-4-12-31-23)14-21(26-28)18-8-10-20(30-2)11-9-18/h3-13,22H,14-16H2,1-2H3/p+1/t22-/m1/s1