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

Systemtic Name: 3-(3-oxidanyl-4-phenyl-butyl)-2-[6-(2H-1,2,3,4-tetrazol-5-yl)hexyl]cyclopentan-1-one Openeye Name: 3-(3-hydroxy-4-phenyl-butyl)-2-[6-(2H-tetrazol-5-yl)hexyl]cyclopentanone CAS Name: 3-(3-hydroxy-4-phenylbutyl)-2-[6-(2H-tetrazol-5-yl)hexyl]-1-cyclopentanone IUPAC Name: 3-(3-hydroxy-4-phenylbutyl)-2-[6-(2H-tetrazol-5-yl)hexyl]cyclopentan-1-one Traditional Name: 3-(3-hydroxy-4-phenyl-butyl)-2-[6-(2H-tetrazol-5-yl)hexyl]cyclopentanone Formula: C22H32N4O2 MolecularWeight: 384.51508

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)C(C1CCC(CC2=CC=CC=C2)O)CCCCCCC3=NNN=N3

Isomeric SMILES

C1CC(=O)C(C1CCC(CC2=CC=CC=C2)O)CCCCCCC3=NNN=N3

InChI

InChI=1S/C22H32N4O2/c27-19(16-17-8-4-3-5-9-17)14-12-18-13-15-21(28)20(18)10-6-1-2-7-11-22-23-25-26-24-22/h3-5,8-9,18-20,27H,1-2,6-7,10-16H2,(H,23,24,25,26)