1-[7-(2-octyloxan-3-yl)-1-[3-(trifluoromethyl)phenyl]heptan-3-yl]pyrrole

Systemtic Name: 1-[7-(2-octyloxan-3-yl)-1-[3-(trifluoromethyl)phenyl]heptan-3-yl]pyrrole Openeye Name: 1-[5-(2-octyltetrahydropyran-3-yl)-1-[2-[3-(trifluoromethyl)phenyl]ethyl]pentyl]pyrrole CAS Name: 1-[7-(2-octyl-3-oxanyl)-1-[3-(trifluoromethyl)phenyl]heptan-3-yl]pyrrole IUPAC Name: 1-[7-(2-octyloxan-3-yl)-1-[3-(trifluoromethyl)phenyl]heptan-3-yl]pyrrole Traditional Name: 1-[5-(2-octyltetrahydropyran-3-yl)-1-[2-[3-(trifluoromethyl)phenyl]ethyl]pentyl]pyrrole Formula: C31H46F3NO MolecularWeight: 505.69825

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1C(CCCO1)CCCCC(CCC2=CC(=CC=C2)C(F)(F)F)N3C=CC=C3

Isomeric SMILES

CCCCCCCCC1C(CCCO1)CCCCC(CCC2=CC(=CC=C2)C(F)(F)F)N3C=CC=C3

InChI

InChI=1S/C31H46F3NO/c1-2-3-4-5-6-7-19-30-27(16-13-24-36-30)15-8-9-18-29(35-22-10-11-23-35)21-20-26-14-12-17-28(25-26)31(32,33)34/h10-12,14,17,22-23,25,27,29-30H,2-9,13,15-16,18-21,24H2,1H3