4-azanyl-3-(7-chloranyl-1-benzofuran-2-yl)butanoic acid

Systemtic Name: 4-azanyl-3-(7-chloranyl-1-benzofuran-2-yl)butanoic acid Openeye Name: 4-amino-3-(7-chlorobenzofuran-2-yl)butanoic acid CAS Name: 4-amino-3-(7-chloro-2-benzofuranyl)butanoic acid IUPAC Name: 4-amino-3-(7-chloro-1-benzofuran-2-yl)butanoic acid Traditional Name: 4-amino-3-(7-chlorobenzofuran-2-yl)butyric acid Formula: C12H12ClNO3 MolecularWeight: 253.68158

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)Cl)OC(=C2)C(CC(=O)O)CN

Isomeric SMILES

C1=CC2=C(C(=C1)Cl)OC(=C2)C(CC(=O)O)CN

InChI

InChI=1S/C12H12ClNO3/c13-9-3-1-2-7-4-10(17-12(7)9)8(6-14)5-11(15)16/h1-4,8H,5-6,14H2,(H,15,16)