6-chloranyl-5-methoxy-4,4-dimethyl-1-(phenylmethyl)-2-(trifluoromethyl)-3H-naphthalene-1,2-diol

Systemtic Name: 6-chloranyl-5-methoxy-4,4-dimethyl-1-(phenylmethyl)-2-(trifluoromethyl)-3H-naphthalene-1,2-diol Openeye Name: 1-benzyl-6-chloro-5-methoxy-4,4-dimethyl-2-(trifluoromethyl)tetralin-1,2-diol CAS Name: 6-chloro-5-methoxy-4,4-dimethyl-1-(phenylmethyl)-2-(trifluoromethyl)-3H-naphthalene-1,2-diol IUPAC Name: 1-benzyl-6-chloro-5-methoxy-4,4-dimethyl-2-(trifluoromethyl)-3H-naphthalene-1,2-diol Traditional Name: 1-benzyl-6-chloro-5-methoxy-4,4-dimethyl-2-(trifluoromethyl)tetralin-1,2-diol Formula: C21H22ClF3O3 MolecularWeight: 414.84579

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C(C2=C1C(=C(C=C2)Cl)OC)(CC3=CC=CC=C3)O)(C(F)(F)F)O)C

Isomeric SMILES

CC1(CC(C(C2=C1C(=C(C=C2)Cl)OC)(CC3=CC=CC=C3)O)(C(F)(F)F)O)C

InChI

InChI=1S/C21H22ClF3O3/c1-18(2)12-20(27,21(23,24)25)19(26,11-13-7-5-4-6-8-13)14-9-10-15(22)17(28-3)16(14)18/h4-10,26-27H,11-12H2,1-3H3