3-[6-azanyl-2-(2-chlorophenyl)carbonyl-1-benzofuran-3-yl]propanoic acid

Systemtic Name: 3-[6-azanyl-2-(2-chlorophenyl)carbonyl-1-benzofuran-3-yl]propanoic acid Openeye Name: 3-[6-amino-2-(2-chlorobenzoyl)benzofuran-3-yl]propanoic acid CAS Name: 3-[6-amino-2-[(2-chlorophenyl)-oxomethyl]-3-benzofuranyl]propanoic acid IUPAC Name: 3-[6-amino-2-(2-chlorobenzoyl)-1-benzofuran-3-yl]propanoic acid Traditional Name: 3-[6-amino-2-(2-chlorobenzoyl)benzofuran-3-yl]propionic acid Formula: C18H14ClNO4 MolecularWeight: 343.76106

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)C2=C(C3=C(O2)C=C(C=C3)N)CCC(=O)O)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)C2=C(C3=C(O2)C=C(C=C3)N)CCC(=O)O)Cl

InChI

InChI=1S/C18H14ClNO4/c19-14-4-2-1-3-13(14)17(23)18-12(7-8-16(21)22)11-6-5-10(20)9-15(11)24-18/h1-6,9H,7-8,20H2,(H,21,22)