2-(dimethylamino)-5-nitro-N-[[2-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]benzamide

Systemtic Name: 2-(dimethylamino)-5-nitro-N-[[2-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]benzamide Openeye Name: 2-(dimethylamino)-5-nitro-N-[[2-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]benzamide CAS Name: 2-(dimethylamino)-5-nitro-N-[[2-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]benzamide IUPAC Name: 2-(dimethylamino)-5-nitro-N-[[2-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]benzamide Traditional Name: 2-(dimethylamino)-5-nitro-N-[2-(1,2,4-triazol-1-ylmethyl)benzyl]benzamide Formula: C19H20N6O3 MolecularWeight: 380.4005

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)[N+](=O)[O-])C(=O)NCC2=CC=CC=C2CN3C=NC=N3

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)[N+](=O)[O-])C(=O)NCC2=CC=CC=C2CN3C=NC=N3

InChI

InChI=1S/C19H20N6O3/c1-23(2)18-8-7-16(25(27)28)9-17(18)19(26)21-10-14-5-3-4-6-15(14)11-24-13-20-12-22-24/h3-9,12-13H,10-11H2,1-2H3,(H,21,26)