[6,6-bis(fluoranyl)-5-methyl-hex-5-enyl] 2-[6,6-bis(fluoranyl)-5-methyl-hex-5-enyl]benzotriazole-5-carboxylate

Systemtic Name: [6,6-bis(fluoranyl)-5-methyl-hex-5-enyl] 2-[6,6-bis(fluoranyl)-5-methyl-hex-5-enyl]benzotriazole-5-carboxylate Openeye Name: (6,6-difluoro-5-methyl-hex-5-enyl) 2-(6,6-difluoro-5-methyl-hex-5-enyl)benzotriazole-5-carboxylate CAS Name: 2-(6,6-difluoro-5-methylhex-5-enyl)-5-benzotriazolecarboxylic acid (6,6-difluoro-5-methylhex-5-enyl) ester IUPAC Name: (6,6-difluoro-5-methylhex-5-enyl) 2-(6,6-difluoro-5-methylhex-5-enyl)benzotriazole-5-carboxylate Traditional Name: 2-(6,6-difluoro-5-methyl-hex-5-enyl)benzotriazole-5-carboxylic acid (6,6-difluoro-5-methyl-hex-5-enyl) ester Formula: C21H25F4N3O2 MolecularWeight: 427.435713

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(F)F)CCCCN1N=C2C=CC(=CC2=N1)C(=O)OCCCCC(=C(F)F)C

Isomeric SMILES

CC(=C(F)F)CCCCN1N=C2C=CC(=CC2=N1)C(=O)OCCCCC(=C(F)F)C

InChI

InChI=1S/C21H25F4N3O2/c1-14(19(22)23)7-3-5-11-28-26-17-10-9-16(13-18(17)27-28)21(29)30-12-6-4-8-15(2)20(24)25/h9-10,13H,3-8,11-12H2,1-2H3