1-(3-nitrophenyl)-N-[(2-pyrrolidin-1-ylpyridin-4-yl)methyl]pyrazole-3-carboxamide

Systemtic Name: 1-(3-nitrophenyl)-N-[(2-pyrrolidin-1-ylpyridin-4-yl)methyl]pyrazole-3-carboxamide Openeye Name: 1-(3-nitrophenyl)-N-[(2-pyrrolidin-1-yl-4-pyridyl)methyl]pyrazole-3-carboxamide CAS Name: 1-(3-nitrophenyl)-N-[[2-(1-pyrrolidinyl)-4-pyridinyl]methyl]-3-pyrazolecarboxamide IUPAC Name: 1-(3-nitrophenyl)-N-[(2-pyrrolidin-1-ylpyridin-4-yl)methyl]pyrazole-3-carboxamide Traditional Name: 1-(3-nitrophenyl)-N-[(2-pyrrolidino-4-pyridyl)methyl]pyrazole-3-carboxamide Formula: C20H20N6O3 MolecularWeight: 392.4112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC=CC(=C2)CNC(=O)C3=NN(C=C3)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=NC=CC(=C2)CNC(=O)C3=NN(C=C3)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H20N6O3/c27-20(22-14-15-6-8-21-19(12-15)24-9-1-2-10-24)18-7-11-25(23-18)16-4-3-5-17(13-16)26(28)29/h3-8,11-13H,1-2,9-10,14H2,(H,22,27)