3-(2-chlorophenyl)-5-(pyrrolidin-1-ylmethyl)-1-benzofuran-2-carboxylic acid

Systemtic Name: 3-(2-chlorophenyl)-5-(pyrrolidin-1-ylmethyl)-1-benzofuran-2-carboxylic acid Openeye Name: 3-(2-chlorophenyl)-5-(pyrrolidin-1-ylmethyl)benzofuran-2-carboxylic acid CAS Name: 3-(2-chlorophenyl)-5-(1-pyrrolidinylmethyl)-2-benzofurancarboxylic acid IUPAC Name: 3-(2-chlorophenyl)-5-(pyrrolidin-1-ylmethyl)-1-benzofuran-2-carboxylic acid Traditional Name: 3-(2-chlorophenyl)-5-(pyrrolidinomethyl)coumarilic acid Formula: C20H18ClNO3 MolecularWeight: 355.81482

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC3=C(C=C2)OC(=C3C4=CC=CC=C4Cl)C(=O)O

Isomeric SMILES

C1CCN(C1)CC2=CC3=C(C=C2)OC(=C3C4=CC=CC=C4Cl)C(=O)O

InChI

InChI=1S/C20H18ClNO3/c21-16-6-2-1-5-14(16)18-15-11-13(12-22-9-3-4-10-22)7-8-17(15)25-19(18)20(23)24/h1-2,5-8,11H,3-4,9-10,12H2,(H,23,24)