4-[5,5-bis(4-fluorophenyl)pent-4-enoylamino]benzoic acid

Systemtic Name: 4-[5,5-bis(4-fluorophenyl)pent-4-enoylamino]benzoic acid Openeye Name: 4-[5,5-bis(4-fluorophenyl)pent-4-enoylamino]benzoic acid CAS Name: 4-[[5,5-bis(4-fluorophenyl)-1-oxopent-4-enyl]amino]benzoic acid IUPAC Name: 4-[5,5-bis(4-fluorophenyl)pent-4-enoylamino]benzoic acid Traditional Name: 4-[5,5-bis(4-fluorophenyl)pent-4-enoylamino]benzoic acid Formula: C24H19F2NO3 MolecularWeight: 407.409366

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)NC(=O)CCC=C(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)NC(=O)CCC=C(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F

InChI

InChI=1S/C24H19F2NO3/c25-19-10-4-16(5-11-19)22(17-6-12-20(26)13-7-17)2-1-3-23(28)27-21-14-8-18(9-15-21)24(29)30/h2,4-15H,1,3H2,(H,27,28)(H,29,30)