1-(1-azacyclohexacos-1-yl)-2,2,2-tris(fluoranyl)ethanone; cyclooctacosane

Systemtic Name: 1-(1-azacyclohexacos-1-yl)-2,2,2-tris(fluoranyl)ethanone; cyclooctacosane Openeye Name: 1-(azacyclohexacos-1-yl)-2,2,2-trifluoro-ethanone; cyclooctacosane CAS Name: 1-(azacyclohexacos-1-yl)-2,2,2-trifluoroethanone; cyclooctacosane IUPAC Name: 1-(azacyclohexacos-1-yl)-2,2,2-trifluoroethanone; cyclooctacosane Traditional Name: 1-(azacyclohexacos-1-yl)-2,2,2-trifluoro-ethanone; cyclooctacosane Formula: C55H106F3NO MolecularWeight: 854.43145

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCCCCCCCCCCCCCCCCCCCCCCCCC1.C1CCCCCCCCCCCCN(CCCCCCCCCCCC1)C(=O)C(F)(F)F

Isomeric SMILES

C1CCCCCCCCCCCCCCCCCCCCCCCCCCC1.C1CCCCCCCCCCCCN(CCCCCCCCCCCC1)C(=O)C(F)(F)F

InChI

InChI=1S/C28H56.C27H50F3NO/c1-2-4-6-8-10-12-14-16-18-20-22-24-26-28-27-25-23-21-19-17-15-13-11-9-7-5-3-1;28-27(29,30)26(32)31-24-22-20-18-16-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15-17-19-21-23-25-31/h1-28H2;1-25H2