(E)-4-[1-[(4-fluorophenyl)methyl]indol-6-yl]-4-oxidanyl-2-oxidanylidene-but-3-enoic acid

Systemtic Name: (E)-4-[1-[(4-fluorophenyl)methyl]indol-6-yl]-4-oxidanyl-2-oxidanylidene-but-3-enoic acid Openeye Name: (E)-4-[1-[(4-fluorophenyl)methyl]indol-6-yl]-4-hydroxy-2-oxo-but-3-enoic acid CAS Name: (E)-4-[1-[(4-fluorophenyl)methyl]-6-indolyl]-4-hydroxy-2-oxo-3-butenoic acid IUPAC Name: (E)-4-[1-[(4-fluorophenyl)methyl]indol-6-yl]-4-hydroxy-2-oxobut-3-enoic acid Traditional Name: (E)-4-[1-(4-fluorobenzyl)indol-6-yl]-4-hydroxy-2-keto-but-3-enoic acid Formula: C19H14FNO4 MolecularWeight: 339.317163

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC2=C1C=CN2CC3=CC=C(C=C3)F)C(=CC(=O)C(=O)O)O

Isomeric SMILES

C1=CC(=CC2=C1C=CN2CC3=CC=C(C=C3)F)/C(=C\C(=O)C(=O)O)/O

InChI

InChI=1S/C19H14FNO4/c20-15-5-1-12(2-6-15)11-21-8-7-13-3-4-14(9-16(13)21)17(22)10-18(23)19(24)25/h1-10,22H,11H2,(H,24,25)/b17-10+