3-[(E)-2-[3,5-bis(chloranyl)phenyl]ethenyl]-2-[6-(2H-1,2,3,4-tetrazol-5-yl)hexyl]cyclopentan-1-one

Systemtic Name: 3-[(E)-2-[3,5-bis(chloranyl)phenyl]ethenyl]-2-[6-(2H-1,2,3,4-tetrazol-5-yl)hexyl]cyclopentan-1-one Openeye Name: 3-[(E)-2-(3,5-dichlorophenyl)vinyl]-2-[6-(2H-tetrazol-5-yl)hexyl]cyclopentanone CAS Name: 3-[(E)-2-(3,5-dichlorophenyl)ethenyl]-2-[6-(2H-tetrazol-5-yl)hexyl]-1-cyclopentanone IUPAC Name: 3-[(E)-2-(3,5-dichlorophenyl)ethenyl]-2-[6-(2H-tetrazol-5-yl)hexyl]cyclopentan-1-one Traditional Name: 3-[(E)-2-(3,5-dichlorophenyl)vinyl]-2-[6-(2H-tetrazol-5-yl)hexyl]cyclopentanone Formula: C20H24Cl2N4O MolecularWeight: 407.33676

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)C(C1C=CC2=CC(=CC(=C2)Cl)Cl)CCCCCCC3=NNN=N3

Isomeric SMILES

C1CC(=O)C(C1/C=C/C2=CC(=CC(=C2)Cl)Cl)CCCCCCC3=NNN=N3

InChI

InChI=1S/C20H24Cl2N4O/c21-16-11-14(12-17(22)13-16)7-8-15-9-10-19(27)18(15)5-3-1-2-4-6-20-23-25-26-24-20/h7-8,11-13,15,18H,1-6,9-10H2,(H,23,24,25,26)/b8-7+