(E)-3-(4-bromanyl-5,5-dimethyl-8-propan-2-yl-3-propan-2-yloxy-6H-naphthalen-2-yl)-2-fluoranyl-but-2-enoic acid

Systemtic Name: (E)-3-(4-bromanyl-5,5-dimethyl-8-propan-2-yl-3-propan-2-yloxy-6H-naphthalen-2-yl)-2-fluoranyl-but-2-enoic acid Openeye Name: (E)-3-(4-bromo-3-isopropoxy-8-isopropyl-5,5-dimethyl-6H-naphthalen-2-yl)-2-fluoro-but-2-enoic acid CAS Name: (E)-3-(4-bromo-5,5-dimethyl-8-propan-2-yl-3-propan-2-yloxy-6H-naphthalen-2-yl)-2-fluoro-2-butenoic acid IUPAC Name: (E)-3-(4-bromo-5,5-dimethyl-8-propan-2-yl-3-propan-2-yloxy-6H-naphthalen-2-yl)-2-fluorobut-2-enoic acid Traditional Name: (E)-3-(4-bromo-3-isopropoxy-8-isopropyl-5,5-dimethyl-6H-naphthalen-2-yl)-2-fluoro-but-2-enoic acid Formula: C22H28BrFO3 MolecularWeight: 439.358323

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CCC(C2=C(C(=C(C=C12)C(=C(C(=O)O)F)C)OC(C)C)Br)(C)C

Isomeric SMILES

CC(C)C1=CCC(C2=C(C(=C(C=C12)/C(=C(\C(=O)O)/F)/C)OC(C)C)Br)(C)C

InChI

InChI=1S/C22H28BrFO3/c1-11(2)14-8-9-22(6,7)17-16(14)10-15(13(5)19(24)21(25)26)20(18(17)23)27-12(3)4/h8,10-12H,9H2,1-7H3,(H,25,26)/b19-13+