3-[4-(4-methylphenoxy)-2-(1-naphthalen-1-ylethylcarbamoyl)phenyl]propanoic acid

Systemtic Name: 3-[4-(4-methylphenoxy)-2-(1-naphthalen-1-ylethylcarbamoyl)phenyl]propanoic acid Openeye Name: 3-[4-(4-methylphenoxy)-2-[1-(1-naphthyl)ethylcarbamoyl]phenyl]propanoic acid CAS Name: 3-[4-(4-methylphenoxy)-2-[[1-(1-naphthalenyl)ethylamino]-oxomethyl]phenyl]propanoic acid IUPAC Name: 3-[4-(4-methylphenoxy)-2-(1-naphthalen-1-ylethylcarbamoyl)phenyl]propanoic acid Traditional Name: 3-[4-(4-methylphenoxy)-2-[1-(1-naphthyl)ethylcarbamoyl]phenyl]propionic acid Formula: C29H27NO4 MolecularWeight: 453.52898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC2=CC(=C(C=C2)CCC(=O)O)C(=O)NC(C)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC1=CC=C(C=C1)OC2=CC(=C(C=C2)CCC(=O)O)C(=O)NC(C)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C29H27NO4/c1-19-10-14-23(15-11-19)34-24-16-12-22(13-17-28(31)32)27(18-24)29(33)30-20(2)25-9-5-7-21-6-3-4-8-26(21)25/h3-12,14-16,18,20H,13,17H2,1-2H3,(H,30,33)(H,31,32)