2-(3-naphthalen-2-ylpropanoylamino)-5-pyridin-3-yl-cyclohexene-1-carboxylic acid

Systemtic Name: 2-(3-naphthalen-2-ylpropanoylamino)-5-pyridin-3-yl-cyclohexene-1-carboxylic acid Openeye Name: 2-[3-(2-naphthyl)propanoylamino]-5-(3-pyridyl)cyclohexene-1-carboxylic acid CAS Name: 2-[[3-(2-naphthalenyl)-1-oxopropyl]amino]-5-(3-pyridinyl)-1-cyclohexenecarboxylic acid IUPAC Name: 2-(3-naphthalen-2-ylpropanoylamino)-5-pyridin-3-ylcyclohexene-1-carboxylic acid Traditional Name: 2-[3-(2-naphthyl)propanoylamino]-5-(3-pyridyl)cyclohexene-1-carboxylic acid Formula: C25H24N2O3 MolecularWeight: 400.46966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H24N2O3/c28-24(12-8-17-7-9-18-4-1-2-5-19(18)14-17)27-23-11-10-20(15-22(23)25(29)30)21-6-3-13-26-16-21/h1-7,9,13-14,16,20H,8,10-12,15H2,(H,27,28)(H,29,30)