4-cyano-3-(2-fluorophenyl)-4-[(E)-pent-1-enyl]cyclohexa-2,5-diene-1-carboxylate

Systemtic Name: 4-cyano-3-(2-fluorophenyl)-4-[(E)-pent-1-enyl]cyclohexa-2,5-diene-1-carboxylate Openeye Name: 4-cyano-3-(2-fluorophenyl)-4-[(E)-pent-1-enyl]cyclohexa-2,5-diene-1-carboxylate CAS Name: 4-cyano-3-(2-fluorophenyl)-4-[(E)-pent-1-enyl]-1-cyclohexa-2,5-dienecarboxylate IUPAC Name: 4-cyano-3-(2-fluorophenyl)-4-[(E)-pent-1-enyl]cyclohexa-2,5-diene-1-carboxylate Traditional Name: 4-cyano-3-(2-fluorophenyl)-4-[(E)-pent-1-enyl]cyclohexa-2,5-diene-1-carboxylate Formula: C19H17FNO2- MolecularWeight: 310.342183

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Descriptors Computed from Structure

Canonical SMILES:

CCCC=CC1(C=CC(C=C1C2=CC=CC=C2F)C(=O)[O-])C#N

Isomeric SMILES

CCC/C=C/C1(C=CC(C=C1C2=CC=CC=C2F)C(=O)[O-])C#N

InChI

InChI=1S/C19H18FNO2/c1-2-3-6-10-19(13-21)11-9-14(18(22)23)12-16(19)15-7-4-5-8-17(15)20/h4-12,14H,2-3H2,1H3,(H,22,23)/p-1/b10-6+