4-[4-ethynyl-2-(2-naphthalen-1-ylpropanoylamino)phenyl]butanoic acid

Systemtic Name: 4-[4-ethynyl-2-(2-naphthalen-1-ylpropanoylamino)phenyl]butanoic acid Openeye Name: 4-[4-ethynyl-2-[2-(1-naphthyl)propanoylamino]phenyl]butanoic acid CAS Name: 4-[4-ethynyl-2-[[2-(1-naphthalenyl)-1-oxopropyl]amino]phenyl]butanoic acid IUPAC Name: 4-[4-ethynyl-2-(2-naphthalen-1-ylpropanoylamino)phenyl]butanoic acid Traditional Name: 4-[4-ethynyl-2-[2-(1-naphthyl)propanoylamino]phenyl]butyric acid Formula: C25H23NO3 MolecularWeight: 385.45502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)C(=O)NC3=C(C=CC(=C3)C#C)CCCC(=O)O

Isomeric SMILES

CC(C1=CC=CC2=CC=CC=C21)C(=O)NC3=C(C=CC(=C3)C#C)CCCC(=O)O

InChI

InChI=1S/C25H23NO3/c1-3-18-14-15-20(10-7-13-24(27)28)23(16-18)26-25(29)17(2)21-12-6-9-19-8-4-5-11-22(19)21/h1,4-6,8-9,11-12,14-17H,7,10,13H2,2H3,(H,26,29)(H,27,28)