2-azanyl-3-[3,5-bis(chloranyl)-4-(2-naphthalen-2-ylethoxy)phenyl]propanoic acid

Systemtic Name: 2-azanyl-3-[3,5-bis(chloranyl)-4-(2-naphthalen-2-ylethoxy)phenyl]propanoic acid Openeye Name: 2-amino-3-[3,5-dichloro-4-[2-(2-naphthyl)ethoxy]phenyl]propanoic acid CAS Name: 2-amino-3-[3,5-dichloro-4-[2-(2-naphthalenyl)ethoxy]phenyl]propanoic acid IUPAC Name: 2-amino-3-[3,5-dichloro-4-(2-naphthalen-2-ylethoxy)phenyl]propanoic acid Traditional Name: 2-amino-3-[3,5-dichloro-4-[2-(2-naphthyl)ethoxy]phenyl]propionic acid Formula: C21H19Cl2NO3 MolecularWeight: 404.28646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)CCOC3=C(C=C(C=C3Cl)CC(C(=O)O)N)Cl

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)CCOC3=C(C=C(C=C3Cl)CC(C(=O)O)N)Cl

InChI

InChI=1S/C21H19Cl2NO3/c22-17-10-14(12-19(24)21(25)26)11-18(23)20(17)27-8-7-13-5-6-15-3-1-2-4-16(15)9-13/h1-6,9-11,19H,7-8,12,24H2,(H,25,26)