methyl (2E)-2-[(4-fluorophenyl)-phenyl-methylidene]hexanoate

Systemtic Name: methyl (2E)-2-[(4-fluorophenyl)-phenyl-methylidene]hexanoate Openeye Name: methyl (2E)-2-[(4-fluorophenyl)-phenyl-methylene]hexanoate CAS Name: (2E)-2-[(4-fluorophenyl)-phenylmethylidene]hexanoic acid methyl ester IUPAC Name: methyl (2E)-2-[(4-fluorophenyl)-phenylmethylidene]hexanoate Traditional Name: (E)-2-butyl-3-(4-fluorophenyl)-3-phenyl-acrylic acid methyl ester Formula: C20H21FO2 MolecularWeight: 312.377943

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=C(C1=CC=CC=C1)C2=CC=C(C=C2)F)C(=O)OC

Isomeric SMILES

CCCC/C(=C(/C1=CC=CC=C1)\C2=CC=C(C=C2)F)/C(=O)OC

InChI

InChI=1S/C20H21FO2/c1-3-4-10-18(20(22)23-2)19(15-8-6-5-7-9-15)16-11-13-17(21)14-12-16/h5-9,11-14H,3-4,10H2,1-2H3/b19-18+