4-(2-phenylethynyl)-N-[3-(1,2,3,4-tetrazol-1-yl)phenyl]benzamide

Systemtic Name: 4-(2-phenylethynyl)-N-[3-(1,2,3,4-tetrazol-1-yl)phenyl]benzamide Openeye Name: 4-(2-phenylethynyl)-N-[3-(tetrazol-1-yl)phenyl]benzamide CAS Name: 4-(2-phenylethynyl)-N-[3-(1-tetrazolyl)phenyl]benzamide IUPAC Name: 4-(2-phenylethynyl)-N-[3-(tetrazol-1-yl)phenyl]benzamide Traditional Name: 4-(2-phenylethynyl)-N-[3-(tetrazol-1-yl)phenyl]benzamide Formula: C22H15N5O MolecularWeight: 365.3874

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CC2=CC=C(C=C2)C(=O)NC3=CC=CC(=C3)N4C=NN=N4

Isomeric SMILES

C1=CC=C(C=C1)C#CC2=CC=C(C=C2)C(=O)NC3=CC=CC(=C3)N4C=NN=N4

InChI

InChI=1S/C22H15N5O/c28-22(24-20-7-4-8-21(15-20)27-16-23-25-26-27)19-13-11-18(12-14-19)10-9-17-5-2-1-3-6-17/h1-8,11-16H,(H,24,28)