2-(4-oxidanyl-4-phenyl-but-1-enyl)-2-[6-(2H-1,2,3,4-tetrazol-5-yl)hexyl]cyclopentan-1-one

Systemtic Name: 2-(4-oxidanyl-4-phenyl-but-1-enyl)-2-[6-(2H-1,2,3,4-tetrazol-5-yl)hexyl]cyclopentan-1-one Openeye Name: 2-(4-hydroxy-4-phenyl-but-1-enyl)-2-[6-(2H-tetrazol-5-yl)hexyl]cyclopentanone CAS Name: 2-(4-hydroxy-4-phenylbut-1-enyl)-2-[6-(2H-tetrazol-5-yl)hexyl]-1-cyclopentanone IUPAC Name: 2-(4-hydroxy-4-phenylbut-1-enyl)-2-[6-(2H-tetrazol-5-yl)hexyl]cyclopentan-1-one Traditional Name: 2-(4-hydroxy-4-phenyl-but-1-enyl)-2-[6-(2H-tetrazol-5-yl)hexyl]cyclopentanone Formula: C22H30N4O2 MolecularWeight: 382.4992

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)C(C1)(CCCCCCC2=NNN=N2)C=CCC(C3=CC=CC=C3)O

Isomeric SMILES

C1CC(=O)C(C1)(CCCCCCC2=NNN=N2)C=CCC(C3=CC=CC=C3)O

InChI

InChI=1S/C22H30N4O2/c27-19(18-10-4-3-5-11-18)12-8-16-22(17-9-13-20(22)28)15-7-2-1-6-14-21-23-25-26-24-21/h3-5,8,10-11,16,19,27H,1-2,6-7,9,12-15,17H2,(H,23,24,25,26)