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

Systemtic Name: (E)-5-[3-(4-fluorophenyl)-1-propan-2-yl-indol-2-yl]-3-oxidanylidene-pent-4-enoic acid Openeye Name: (E)-5-[3-(4-fluorophenyl)-1-isopropyl-indol-2-yl]-3-oxo-pent-4-enoic acid CAS Name: (E)-5-[3-(4-fluorophenyl)-1-propan-2-yl-2-indolyl]-3-oxo-4-pentenoic acid IUPAC Name: (E)-5-[3-(4-fluorophenyl)-1-propan-2-ylindol-2-yl]-3-oxopent-4-enoic acid Traditional Name: (E)-5-[3-(4-fluorophenyl)-1-isopropyl-indol-2-yl]-3-keto-pent-4-enoic acid Formula: C22H20FNO3 MolecularWeight: 365.397503

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H20FNO3/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/h3-12,14H,13H2,1-2H3,(H,26,27)/b12-11+