2-(benzotriazol-1-yl)-N-(3-ethynylphenyl)ethanamide

Systemtic Name: 2-(benzotriazol-1-yl)-N-(3-ethynylphenyl)ethanamide Openeye Name: 2-(benzotriazol-1-yl)-N-(3-ethynylphenyl)acetamide CAS Name: 2-(1-benzotriazolyl)-N-(3-ethynylphenyl)acetamide IUPAC Name: 2-(benzotriazol-1-yl)-N-(3-ethynylphenyl)acetamide Traditional Name: 2-(benzotriazol-1-yl)-N-(3-ethynylphenyl)acetamide Formula: C16H12N4O MolecularWeight: 276.29268

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)NC(=O)CN2C3=CC=CC=C3N=N2

Isomeric SMILES

C#CC1=CC(=CC=C1)NC(=O)CN2C3=CC=CC=C3N=N2

InChI

InChI=1S/C16H12N4O/c1-2-12-6-5-7-13(10-12)17-16(21)11-20-15-9-4-3-8-14(15)18-19-20/h1,3-10H,11H2,(H,17,21)