(E)-5-[3-(4-fluorophenyl)-1-propan-2-yl-indol-2-yl]-3-oxidanyl-pent-4-enoic acid

Systemtic Name: (E)-5-[3-(4-fluorophenyl)-1-propan-2-yl-indol-2-yl]-3-oxidanyl-pent-4-enoic acid Openeye Name: (E)-5-[3-(4-fluorophenyl)-1-isopropyl-indol-2-yl]-3-hydroxy-pent-4-enoic acid CAS Name: (E)-5-[3-(4-fluorophenyl)-1-propan-2-yl-2-indolyl]-3-hydroxy-4-pentenoic acid IUPAC Name: (E)-5-[3-(4-fluorophenyl)-1-propan-2-ylindol-2-yl]-3-hydroxypent-4-enoic acid Traditional Name: (E)-5-[3-(4-fluorophenyl)-1-isopropyl-indol-2-yl]-3-hydroxy-pent-4-enoic acid Formula: C22H22FNO3 MolecularWeight: 367.413383

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=CC=CC=C2C(=C1C=CC(CC(=O)O)O)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C)N1C2=CC=CC=C2C(=C1/C=C/C(CC(=O)O)O)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H22FNO3/c1-14(2)24-19-6-4-3-5-18(19)22(15-7-9-16(23)10-8-15)20(24)12-11-17(25)13-21(26)27/h3-12,14,17,25H,13H2,1-2H3,(H,26,27)/b12-11+