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

Systemtic Name: 4-[2-(2-naphthalen-1-ylpropanoylamino)-4-phenoxy-phenyl]butanoic acid Openeye Name: 4-[2-[2-(1-naphthyl)propanoylamino]-4-phenoxy-phenyl]butanoic acid CAS Name: 4-[2-[[2-(1-naphthalenyl)-1-oxopropyl]amino]-4-phenoxyphenyl]butanoic acid IUPAC Name: 4-[2-(2-naphthalen-1-ylpropanoylamino)-4-phenoxyphenyl]butanoic acid Traditional Name: 4-[2-[2-(1-naphthyl)propanoylamino]-4-phenoxy-phenyl]butyric acid Formula: C29H27NO4 MolecularWeight: 453.52898

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)OC4=CC=CC=C4)CCCC(=O)O

Isomeric SMILES

CC(C1=CC=CC2=CC=CC=C21)C(=O)NC3=C(C=CC(=C3)OC4=CC=CC=C4)CCCC(=O)O

InChI

InChI=1S/C29H27NO4/c1-20(25-15-7-10-21-9-5-6-14-26(21)25)29(33)30-27-19-24(34-23-12-3-2-4-13-23)18-17-22(27)11-8-16-28(31)32/h2-7,9-10,12-15,17-20H,8,11,16H2,1H3,(H,30,33)(H,31,32)