1-[5-methoxy-1-[4-(2H-1,2,3,4-tetrazol-5-yl)phenyl]pyrazol-3-yl]ethanone

Systemtic Name: 1-[5-methoxy-1-[4-(2H-1,2,3,4-tetrazol-5-yl)phenyl]pyrazol-3-yl]ethanone Openeye Name: 1-[5-methoxy-1-[4-(2H-tetrazol-5-yl)phenyl]pyrazol-3-yl]ethanone CAS Name: 1-[5-methoxy-1-[4-(2H-tetrazol-5-yl)phenyl]-3-pyrazolyl]ethanone IUPAC Name: 1-[5-methoxy-1-[4-(2H-tetrazol-5-yl)phenyl]pyrazol-3-yl]ethanone Traditional Name: 1-[5-methoxy-1-[4-(2H-tetrazol-5-yl)phenyl]pyrazol-3-yl]ethanone Formula: C13H12N6O2 MolecularWeight: 284.27338

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=NN(C(=C1)OC)C2=CC=C(C=C2)C3=NNN=N3

Isomeric SMILES

CC(=O)C1=NN(C(=C1)OC)C2=CC=C(C=C2)C3=NNN=N3

InChI

InChI=1S/C13H12N6O2/c1-8(20)11-7-12(21-2)19(16-11)10-5-3-9(4-6-10)13-14-17-18-15-13/h3-7H,1-2H3,(H,14,15,17,18)