7-phenyl-1-(2-phenyl-1,2,3,4-tetrazol-5-yl)heptan-1-one

Systemtic Name: 7-phenyl-1-(2-phenyl-1,2,3,4-tetrazol-5-yl)heptan-1-one Openeye Name: 7-phenyl-1-(2-phenyltetrazol-5-yl)heptan-1-one CAS Name: 7-phenyl-1-(2-phenyl-5-tetrazolyl)-1-heptanone IUPAC Name: 7-phenyl-1-(2-phenyltetrazol-5-yl)heptan-1-one Traditional Name: 7-phenyl-1-(2-phenyltetrazol-5-yl)heptan-1-one Formula: C20H22N4O MolecularWeight: 334.41488

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCCCC(=O)C2=NN(N=N2)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CCCCCCC(=O)C2=NN(N=N2)C3=CC=CC=C3

InChI

InChI=1S/C20H22N4O/c25-19(16-10-2-1-5-11-17-12-6-3-7-13-17)20-21-23-24(22-20)18-14-8-4-9-15-18/h3-4,6-9,12-15H,1-2,5,10-11,16H2