N-[[1-(3-fluorophenyl)-1,2,3,4-tetrazol-5-yl]methyl]-2-methyl-3-nitro-benzamide

Systemtic Name: N-[[1-(3-fluorophenyl)-1,2,3,4-tetrazol-5-yl]methyl]-2-methyl-3-nitro-benzamide Openeye Name: N-[[1-(3-fluorophenyl)tetrazol-5-yl]methyl]-2-methyl-3-nitro-benzamide CAS Name: N-[[1-(3-fluorophenyl)-5-tetrazolyl]methyl]-2-methyl-3-nitrobenzamide IUPAC Name: N-[[1-(3-fluorophenyl)tetrazol-5-yl]methyl]-2-methyl-3-nitrobenzamide Traditional Name: N-[[1-(3-fluorophenyl)tetrazol-5-yl]methyl]-2-methyl-3-nitro-benzamide Formula: C16H13FN6O3 MolecularWeight: 356.311223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NCC2=NN=NN2C3=CC(=CC=C3)F

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NCC2=NN=NN2C3=CC(=CC=C3)F

InChI

InChI=1S/C16H13FN6O3/c1-10-13(6-3-7-14(10)23(25)26)16(24)18-9-15-19-20-21-22(15)12-5-2-4-11(17)8-12/h2-8H,9H2,1H3,(H,18,24)