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

Systemtic Name: 4-(dimethylamino)-N-[[2-(3-fluoranylphenoxy)pyridin-3-yl]methyl]-3-nitro-benzamide Openeye Name: 4-(dimethylamino)-N-[[2-(3-fluorophenoxy)-3-pyridyl]methyl]-3-nitro-benzamide CAS Name: 4-(dimethylamino)-N-[[2-(3-fluorophenoxy)-3-pyridinyl]methyl]-3-nitrobenzamide IUPAC Name: 4-(dimethylamino)-N-[[2-(3-fluorophenoxy)pyridin-3-yl]methyl]-3-nitrobenzamide Traditional Name: 4-(dimethylamino)-N-[[2-(3-fluorophenoxy)-3-pyridyl]methyl]-3-nitro-benzamide Formula: C21H19FN4O4 MolecularWeight: 410.398363

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)C(=O)NCC2=C(N=CC=C2)OC3=CC(=CC=C3)F)[N+](=O)[O-]

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)C(=O)NCC2=C(N=CC=C2)OC3=CC(=CC=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C21H19FN4O4/c1-25(2)18-9-8-14(11-19(18)26(28)29)20(27)24-13-15-5-4-10-23-21(15)30-17-7-3-6-16(22)12-17/h3-12H,13H2,1-2H3,(H,24,27)