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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C=C2C(=O)C3=C(O2)C(=C(C=C3)O)CN4CCCC4

Isomeric SMILES

CC1=CC=CC(=C1)C=C2C(=O)C3=C(O2)C(=C(C=C3)O)CN4CCCC4

InChI

InChI=1S/C21H21NO3/c1-14-5-4-6-15(11-14)12-19-20(24)16-7-8-18(23)17(21(16)25-19)13-22-9-2-3-10-22/h4-8,11-12,23H,2-3,9-10,13H2,1H3