3-[6-acetamido-2-(4-chlorophenyl)carbonyl-1-benzofuran-3-yl]propanoic acid

Systemtic Name: 3-[6-acetamido-2-(4-chlorophenyl)carbonyl-1-benzofuran-3-yl]propanoic acid Openeye Name: 3-[6-acetamido-2-(4-chlorobenzoyl)benzofuran-3-yl]propanoic acid CAS Name: 3-[6-acetamido-2-[(4-chlorophenyl)-oxomethyl]-3-benzofuranyl]propanoic acid IUPAC Name: 3-[6-acetamido-2-(4-chlorobenzoyl)-1-benzofuran-3-yl]propanoic acid Traditional Name: 3-[6-acetamido-2-(4-chlorobenzoyl)benzofuran-3-yl]propionic acid Formula: C20H16ClNO5 MolecularWeight: 385.79774

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)C(=C(O2)C(=O)C3=CC=C(C=C3)Cl)CCC(=O)O

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)C(=C(O2)C(=O)C3=CC=C(C=C3)Cl)CCC(=O)O

InChI

InChI=1S/C20H16ClNO5/c1-11(23)22-14-6-7-15-16(8-9-18(24)25)20(27-17(15)10-14)19(26)12-2-4-13(21)5-3-12/h2-7,10H,8-9H2,1H3,(H,22,23)(H,24,25)