N-(2,5-dimethylpyrrol-1-yl)-3-nitro-benzamide

Systemtic Name: N-(2,5-dimethylpyrrol-1-yl)-3-nitro-benzamide Openeye Name: N-(2,5-dimethylpyrrol-1-yl)-3-nitro-benzamide CAS Name: N-(2,5-dimethyl-1-pyrrolyl)-3-nitrobenzamide IUPAC Name: N-(2,5-dimethylpyrrol-1-yl)-3-nitrobenzamide Traditional Name: N-(2,5-dimethylpyrrol-1-yl)-3-nitro-benzamide Formula: C13H13N3O3 MolecularWeight: 259.26062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC=C(N1NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C

InChI

InChI=1S/C13H13N3O3/c1-9-6-7-10(2)15(9)14-13(17)11-4-3-5-12(8-11)16(18)19/h3-8H,1-2H3,(H,14,17)