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

Systemtic Name: 2-azanyl-3-[3,5-bis(chloranyl)-4-(dibenzofuran-4-ylmethoxy)phenyl]propanoic acid Openeye Name: 2-amino-3-[3,5-dichloro-4-(dibenzofuran-4-ylmethoxy)phenyl]propanoic acid CAS Name: 2-amino-3-[3,5-dichloro-4-(4-dibenzofuranylmethoxy)phenyl]propanoic acid IUPAC Name: 2-amino-3-[3,5-dichloro-4-(dibenzofuran-4-ylmethoxy)phenyl]propanoic acid Traditional Name: 2-amino-3-[3,5-dichloro-4-(dibenzofuran-4-ylmethoxy)phenyl]propionic acid Formula: C22H17Cl2NO4 MolecularWeight: 430.28068

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(O2)C(=CC=C3)COC4=C(C=C(C=C4Cl)CC(C(=O)O)N)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(O2)C(=CC=C3)COC4=C(C=C(C=C4Cl)CC(C(=O)O)N)Cl

InChI

InChI=1S/C22H17Cl2NO4/c23-16-8-12(10-18(25)22(26)27)9-17(24)21(16)28-11-13-4-3-6-15-14-5-1-2-7-19(14)29-20(13)15/h1-9,18H,10-11,25H2,(H,26,27)