(E)-3-cyano-3-[1-[(4-fluorophenyl)methyl]indol-3-yl]-2-oxidanyl-prop-2-enoic acid

Systemtic Name: (E)-3-cyano-3-[1-[(4-fluorophenyl)methyl]indol-3-yl]-2-oxidanyl-prop-2-enoic acid Openeye Name: (E)-3-cyano-3-[1-[(4-fluorophenyl)methyl]indol-3-yl]-2-hydroxy-prop-2-enoic acid CAS Name: (E)-3-cyano-3-[1-[(4-fluorophenyl)methyl]-3-indolyl]-2-hydroxy-2-propenoic acid IUPAC Name: (E)-3-cyano-3-[1-[(4-fluorophenyl)methyl]indol-3-yl]-2-hydroxyprop-2-enoic acid Traditional Name: (E)-3-cyano-3-[1-(4-fluorobenzyl)indol-3-yl]-2-hydroxy-acrylic acid Formula: C19H13FN2O3 MolecularWeight: 336.316523

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2CC3=CC=C(C=C3)F)C(=C(C(=O)O)O)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2CC3=CC=C(C=C3)F)/C(=C(/C(=O)O)\O)/C#N

InChI

InChI=1S/C19H13FN2O3/c20-13-7-5-12(6-8-13)10-22-11-16(14-3-1-2-4-17(14)22)15(9-21)18(23)19(24)25/h1-8,11,23H,10H2,(H,24,25)/b18-15-