5-chloranyl-1-(4-fluorophenyl)-N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-methyl-pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-1-(4-fluorophenyl)-N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-methyl-pyrazole-4-carboxamide Openeye Name: 5-chloro-1-(4-fluorophenyl)-N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-methyl-pyrazole-4-carboxamide CAS Name: 5-chloro-1-(4-fluorophenyl)-N-[(2R)-2-(2-methoxyphenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-3-methyl-4-pyrazolecarboxamide IUPAC Name: 5-chloro-1-(4-fluorophenyl)-N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-ylethyl]-3-methylpyrazole-4-carboxamide Traditional Name: 5-chloro-1-(4-fluorophenyl)-N-[(2R)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-3-methyl-pyrazole-4-carboxamide Formula: C24H27ClFN4O2+ MolecularWeight: 457.948183

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NCC(C2=CC=CC=C2OC)[NH+]3CCCC3)Cl)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=NN(C(=C1C(=O)NC[C@@H](C2=CC=CC=C2OC)[NH+]3CCCC3)Cl)C4=CC=C(C=C4)F

InChI

InChI=1S/C24H26ClFN4O2/c1-16-22(23(25)30(28-16)18-11-9-17(26)10-12-18)24(31)27-15-20(29-13-5-6-14-29)19-7-3-4-8-21(19)32-2/h3-4,7-12,20H,5-6,13-15H2,1-2H3,(H,27,31)/p+1/t20-/m0/s1