(E,3S,5R)-1-[2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl]hept-1-ene-3,5-diol

Systemtic Name: (E,3S,5R)-1-[2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl]hept-1-ene-3,5-diol Openeye Name: (E,3S,5R)-1-[2-cyclopropyl-4-(4-fluorophenyl)-3-quinolyl]hept-1-ene-3,5-diol CAS Name: (E,3S,5R)-1-[2-cyclopropyl-4-(4-fluorophenyl)-3-quinolinyl]-1-heptene-3,5-diol IUPAC Name: (E,3S,5R)-1-[2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl]hept-1-ene-3,5-diol Traditional Name: (E,3S,5R)-1-[2-cyclopropyl-4-(4-fluorophenyl)-3-quinolyl]hept-1-ene-3,5-diol Formula: C25H26FNO2 MolecularWeight: 391.477843

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(C=CC1=C(C2=CC=CC=C2N=C1C3CC3)C4=CC=C(C=C4)F)O)O

Isomeric SMILES

CC[C@H](C[C@@H](/C=C/C1=C(C2=CC=CC=C2N=C1C3CC3)C4=CC=C(C=C4)F)O)O

InChI

InChI=1S/C25H26FNO2/c1-2-19(28)15-20(29)13-14-22-24(16-9-11-18(26)12-10-16)21-5-3-4-6-23(21)27-25(22)17-7-8-17/h3-6,9-14,17,19-20,28-29H,2,7-8,15H2,1H3/b14-13+/t19-,20-/m1/s1