1-Naphthylacetic acid - 1-(4-methylphenyl)ethyl nicotinate (1:1)

ChemSpider ID: 175132
Molecular Formula: C₂₇H₂₅NO₄
Monoisotopic mass: 427.178345 Da
Systematic name

1-Naphthylacetic acid - 1-(4-methylphenyl)ethyl nicotinate (1:1)
SMILES and InChIs

SMILES:

O=C(OC(c1ccc(cc1)C)C)c2cccnc2.O=C(O)Cc2c1ccccc1ccc2 Copied

Std. InChI:

InChI=1S/C15H15NO2.C12H10O2/c1-11-5-7-13(8-6-11)12(2)18-15(17)14-4-3-9-16-10-14;13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h3-10,12H,1-2H3;1-7H,8H2,(H,13,14) Copied

Std. InChIKey:

LBHVOYUTVPQHNS-UHFFFAOYSA-N Copied

Names and Identifiers

Predicted data is generated using the ACD/Labs’ ACD/PhysChem Suite, for more information see their website.

Patents	Personal Collections
Publication or Magazine Article	Web-based Article (blog or commentary)
Available Chemicals Databases	Biological Properties
Chemical Reactions	Chemical Safety Data
Drugs or Compounds in Development	Imaging Agents
Information Aggregators	Journal Publishers via MeSH
Ligand/binding/crystal Structure Databases	Metabolic Pathways
Molecular Libraries Screening Center Network	Natural Products
NIH Substance Repository	Physical Properties (including SAR/QSAR databases)
Protein 3D Structures	Spectroscopy Databases
Substance Vendors	Theoretical Properties
Toxicology/Environmental Databases	Virtual Library