2-[(2-methylphenyl)methylidene]-6-oxidanyl-7-(pyrrolidin-1-ylmethyl)-1-benzofuran-3-one

Systemtic Name: 2-[(2-methylphenyl)methylidene]-6-oxidanyl-7-(pyrrolidin-1-ylmethyl)-1-benzofuran-3-one Openeye Name: 6-hydroxy-2-(o-tolylmethylene)-7-(pyrrolidin-1-ylmethyl)benzofuran-3-one CAS Name: 6-hydroxy-2-[(2-methylphenyl)methylidene]-7-(1-pyrrolidinylmethyl)-3-benzofuranone IUPAC Name: 6-hydroxy-2-[(2-methylphenyl)methylidene]-7-(pyrrolidin-1-ylmethyl)-1-benzofuran-3-one Traditional Name: 6-hydroxy-2-(2-methylbenzylidene)-7-(pyrrolidinomethyl)coumaran-3-one Formula: C21H21NO3 MolecularWeight: 335.39634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C=C2C(=O)C3=C(O2)C(=C(C=C3)O)CN4CCCC4

Isomeric SMILES

CC1=CC=CC=C1C=C2C(=O)C3=C(O2)C(=C(C=C3)O)CN4CCCC4

InChI

InChI=1S/C21H21NO3/c1-14-6-2-3-7-15(14)12-19-20(24)16-8-9-18(23)17(21(16)25-19)13-22-10-4-5-11-22/h2-3,6-9,12,23H,4-5,10-11,13H2,1H3