5-(4-fluorophenyl)-2-(3-naphthalen-2-ylpropanoylamino)cyclohexene-1-carboxylic acid

Systemtic Name: 5-(4-fluorophenyl)-2-(3-naphthalen-2-ylpropanoylamino)cyclohexene-1-carboxylic acid Openeye Name: 5-(4-fluorophenyl)-2-[3-(2-naphthyl)propanoylamino]cyclohexene-1-carboxylic acid CAS Name: 5-(4-fluorophenyl)-2-[[3-(2-naphthalenyl)-1-oxopropyl]amino]-1-cyclohexenecarboxylic acid IUPAC Name: 5-(4-fluorophenyl)-2-(3-naphthalen-2-ylpropanoylamino)cyclohexene-1-carboxylic acid Traditional Name: 5-(4-fluorophenyl)-2-[3-(2-naphthyl)propanoylamino]cyclohexene-1-carboxylic acid Formula: C26H24FNO3 MolecularWeight: 417.472063

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=C(CC1C2=CC=C(C=C2)F)C(=O)O)NC(=O)CCC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CC(=C(CC1C2=CC=C(C=C2)F)C(=O)O)NC(=O)CCC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C26H24FNO3/c27-22-11-8-19(9-12-22)21-10-13-24(23(16-21)26(30)31)28-25(29)14-6-17-5-7-18-3-1-2-4-20(18)15-17/h1-5,7-9,11-12,15,21H,6,10,13-14,16H2,(H,28,29)(H,30,31)