5-(4-fluorophenyl)-2-[3-(4-phenylphenyl)propanoylamino]cyclohexene-1-carboxylic acid

Systemtic Name: 5-(4-fluorophenyl)-2-[3-(4-phenylphenyl)propanoylamino]cyclohexene-1-carboxylic acid Openeye Name: 5-(4-fluorophenyl)-2-[3-(4-phenylphenyl)propanoylamino]cyclohexene-1-carboxylic acid CAS Name: 5-(4-fluorophenyl)-2-[[1-oxo-3-(4-phenylphenyl)propyl]amino]-1-cyclohexenecarboxylic acid IUPAC Name: 5-(4-fluorophenyl)-2-[3-(4-phenylphenyl)propanoylamino]cyclohexene-1-carboxylic acid Traditional Name: 5-(4-fluorophenyl)-2-[3-(4-phenylphenyl)propanoylamino]cyclohexene-1-carboxylic acid Formula: C28H26FNO3 MolecularWeight: 443.509343

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=C(CC1C2=CC=C(C=C2)F)C(=O)O)NC(=O)CCC3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

C1CC(=C(CC1C2=CC=C(C=C2)F)C(=O)O)NC(=O)CCC3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H26FNO3/c29-24-14-11-22(12-15-24)23-13-16-26(25(18-23)28(32)33)30-27(31)17-8-19-6-9-21(10-7-19)20-4-2-1-3-5-20/h1-7,9-12,14-15,23H,8,13,16-18H2,(H,30,31)(H,32,33)