2-[2-azanyl-4-[3-phenylmethoxy-5-(trifluoromethyl)phenoxy]phenyl]hexane-1,3-diol

Systemtic Name: 2-[2-azanyl-4-[3-phenylmethoxy-5-(trifluoromethyl)phenoxy]phenyl]hexane-1,3-diol Openeye Name: 2-[2-amino-4-[3-benzyloxy-5-(trifluoromethyl)phenoxy]phenyl]hexane-1,3-diol CAS Name: 2-[2-amino-4-[3-phenylmethoxy-5-(trifluoromethyl)phenoxy]phenyl]hexane-1,3-diol IUPAC Name: 2-[2-amino-4-[3-phenylmethoxy-5-(trifluoromethyl)phenoxy]phenyl]hexane-1,3-diol Traditional Name: 2-[2-amino-4-[3-benzoxy-5-(trifluoromethyl)phenoxy]phenyl]hexane-1,3-diol Formula: C26H28F3NO4 MolecularWeight: 475.50003

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(CO)C1=C(C=C(C=C1)OC2=CC(=CC(=C2)C(F)(F)F)OCC3=CC=CC=C3)N)O

Isomeric SMILES

CCCC(C(CO)C1=C(C=C(C=C1)OC2=CC(=CC(=C2)C(F)(F)F)OCC3=CC=CC=C3)N)O

InChI

InChI=1S/C26H28F3NO4/c1-2-6-25(32)23(15-31)22-10-9-19(14-24(22)30)34-21-12-18(26(27,28)29)11-20(13-21)33-16-17-7-4-3-5-8-17/h3-5,7-14,23,25,31-32H,2,6,15-16,30H2,1H3