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

Systemtic Name: 3-[6-acetamido-2-(3-methoxyphenyl)carbonyl-1-benzofuran-3-yl]propanoic acid Openeye Name: 3-[6-acetamido-2-(3-methoxybenzoyl)benzofuran-3-yl]propanoic acid CAS Name: 3-[6-acetamido-2-[(3-methoxyphenyl)-oxomethyl]-3-benzofuranyl]propanoic acid IUPAC Name: 3-[6-acetamido-2-(3-methoxybenzoyl)-1-benzofuran-3-yl]propanoic acid Traditional Name: 3-(6-acetamido-2-m-anisoyl-benzofuran-3-yl)propionic acid Formula: C21H19NO6 MolecularWeight: 381.37866

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19NO6/c1-12(23)22-14-6-7-16-17(8-9-19(24)25)21(28-18(16)11-14)20(26)13-4-3-5-15(10-13)27-2/h3-7,10-11H,8-9H2,1-2H3,(H,22,23)(H,24,25)