N-[[2-(3-fluoranylphenoxy)pyridin-3-yl]methyl]-3-nitro-4-pyrrolidin-1-yl-benzamide

Systemtic Name: N-[[2-(3-fluoranylphenoxy)pyridin-3-yl]methyl]-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-[[2-(3-fluorophenoxy)-3-pyridyl]methyl]-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-[[2-(3-fluorophenoxy)-3-pyridinyl]methyl]-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-[[2-(3-fluorophenoxy)pyridin-3-yl]methyl]-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-[[2-(3-fluorophenoxy)-3-pyridyl]methyl]-3-nitro-4-pyrrolidino-benzamide Formula: C23H21FN4O4 MolecularWeight: 436.435643

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C(=O)NCC3=C(N=CC=C3)OC4=CC(=CC=C4)F)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C(=O)NCC3=C(N=CC=C3)OC4=CC(=CC=C4)F)[N+](=O)[O-]

InChI

InChI=1S/C23H21FN4O4/c24-18-6-3-7-19(14-18)32-23-17(5-4-10-25-23)15-26-22(29)16-8-9-20(21(13-16)28(30)31)27-11-1-2-12-27/h3-10,13-14H,1-2,11-12,15H2,(H,26,29)