(E)-4-[5-[(4-fluorophenyl)methyl]-1-methyl-pyrrol-2-yl]-4-oxidanyl-2-oxidanylidene-but-3-enoic acid

Systemtic Name: (E)-4-[5-[(4-fluorophenyl)methyl]-1-methyl-pyrrol-2-yl]-4-oxidanyl-2-oxidanylidene-but-3-enoic acid Openeye Name: (E)-4-[5-[(4-fluorophenyl)methyl]-1-methyl-pyrrol-2-yl]-4-hydroxy-2-oxo-but-3-enoic acid CAS Name: (E)-4-[5-[(4-fluorophenyl)methyl]-1-methyl-2-pyrrolyl]-4-hydroxy-2-oxo-3-butenoic acid IUPAC Name: (E)-4-[5-[(4-fluorophenyl)methyl]-1-methylpyrrol-2-yl]-4-hydroxy-2-oxobut-3-enoic acid Traditional Name: (E)-4-[5-(4-fluorobenzyl)-1-methyl-pyrrol-2-yl]-4-hydroxy-2-keto-but-3-enoic acid Formula: C16H14FNO4 MolecularWeight: 303.285063

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=C1C(=CC(=O)C(=O)O)O)CC2=CC=C(C=C2)F

Isomeric SMILES

CN1C(=CC=C1/C(=C\C(=O)C(=O)O)/O)CC2=CC=C(C=C2)F

InChI

InChI=1S/C16H14FNO4/c1-18-12(8-10-2-4-11(17)5-3-10)6-7-13(18)14(19)9-15(20)16(21)22/h2-7,9,19H,8H2,1H3,(H,21,22)/b14-9+