5-(2-fluorophenyl)-2-(4-nitrophenyl)-N-(2-pyrrolidin-1-ylethyl)pyrazole-3-carboxamide

Systemtic Name: 5-(2-fluorophenyl)-2-(4-nitrophenyl)-N-(2-pyrrolidin-1-ylethyl)pyrazole-3-carboxamide Openeye Name: 5-(2-fluorophenyl)-2-(4-nitrophenyl)-N-(2-pyrrolidin-1-ylethyl)pyrazole-3-carboxamide CAS Name: 5-(2-fluorophenyl)-2-(4-nitrophenyl)-N-[2-(1-pyrrolidinyl)ethyl]-3-pyrazolecarboxamide IUPAC Name: 5-(2-fluorophenyl)-2-(4-nitrophenyl)-N-(2-pyrrolidin-1-ylethyl)pyrazole-3-carboxamide Traditional Name: 5-(2-fluorophenyl)-2-(4-nitrophenyl)-N-(2-pyrrolidinoethyl)pyrazole-3-carboxamide Formula: C22H22FN5O3 MolecularWeight: 423.440183

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCNC(=O)C2=CC(=NN2C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4F

Isomeric SMILES

C1CCN(C1)CCNC(=O)C2=CC(=NN2C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4F

InChI

InChI=1S/C22H22FN5O3/c23-19-6-2-1-5-18(19)20-15-21(22(29)24-11-14-26-12-3-4-13-26)27(25-20)16-7-9-17(10-8-16)28(30)31/h1-2,5-10,15H,3-4,11-14H2,(H,24,29)