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

Systemtic Name: 3-[4-(2-cyanophenoxy)-2-(1-naphthalen-1-ylethylcarbamoyl)phenyl]propanoic acid Openeye Name: 3-[4-(2-cyanophenoxy)-2-[1-(1-naphthyl)ethylcarbamoyl]phenyl]propanoic acid CAS Name: 3-[4-(2-cyanophenoxy)-2-[[1-(1-naphthalenyl)ethylamino]-oxomethyl]phenyl]propanoic acid IUPAC Name: 3-[4-(2-cyanophenoxy)-2-(1-naphthalen-1-ylethylcarbamoyl)phenyl]propanoic acid Traditional Name: 3-[4-(2-cyanophenoxy)-2-[1-(1-naphthyl)ethylcarbamoyl]phenyl]propionic acid Formula: C29H24N2O4 MolecularWeight: 464.51186

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)NC(=O)C3=C(C=CC(=C3)OC4=CC=CC=C4C#N)CCC(=O)O

Isomeric SMILES

CC(C1=CC=CC2=CC=CC=C21)NC(=O)C3=C(C=CC(=C3)OC4=CC=CC=C4C#N)CCC(=O)O

InChI

InChI=1S/C29H24N2O4/c1-19(24-11-6-9-20-7-2-4-10-25(20)24)31-29(34)26-17-23(15-13-21(26)14-16-28(32)33)35-27-12-5-3-8-22(27)18-30/h2-13,15,17,19H,14,16H2,1H3,(H,31,34)(H,32,33)