3-methyl-4-nitro-N-[3-(2-pyridin-2-ylethynyl)phenyl]benzamide

Systemtic Name: 3-methyl-4-nitro-N-[3-(2-pyridin-2-ylethynyl)phenyl]benzamide Openeye Name: 3-methyl-4-nitro-N-[3-[2-(2-pyridyl)ethynyl]phenyl]benzamide CAS Name: 3-methyl-4-nitro-N-[3-[2-(2-pyridinyl)ethynyl]phenyl]benzamide IUPAC Name: 3-methyl-4-nitro-N-[3-(2-pyridin-2-ylethynyl)phenyl]benzamide Traditional Name: 3-methyl-4-nitro-N-[3-[2-(2-pyridyl)ethynyl]phenyl]benzamide Formula: C21H15N3O3 MolecularWeight: 357.3621

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NC2=CC=CC(=C2)C#CC3=CC=CC=N3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NC2=CC=CC(=C2)C#CC3=CC=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C21H15N3O3/c1-15-13-17(9-11-20(15)24(26)27)21(25)23-19-7-4-5-16(14-19)8-10-18-6-2-3-12-22-18/h2-7,9,11-14H,1H3,(H,23,25)