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

Systemtic Name: 4-methyl-3-nitro-N-[3-(2-pyridin-2-ylethynyl)phenyl]benzamide Openeye Name: 4-methyl-3-nitro-N-[3-[2-(2-pyridyl)ethynyl]phenyl]benzamide CAS Name: 4-methyl-3-nitro-N-[3-[2-(2-pyridinyl)ethynyl]phenyl]benzamide IUPAC Name: 4-methyl-3-nitro-N-[3-(2-pyridin-2-ylethynyl)phenyl]benzamide Traditional Name: 4-methyl-3-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=C(C=C1)C(=O)NC2=CC=CC(=C2)C#CC3=CC=CC=N3)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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