(2Z)-4-methyl-6-oxidanyl-2-(phenylmethylidene)-7-(pyrrolidin-1-ylmethyl)-1-benzofuran-3-one

Systemtic Name: (2Z)-4-methyl-6-oxidanyl-2-(phenylmethylidene)-7-(pyrrolidin-1-ylmethyl)-1-benzofuran-3-one Openeye Name: (2Z)-2-benzylidene-6-hydroxy-4-methyl-7-(pyrrolidin-1-ylmethyl)benzofuran-3-one CAS Name: (2Z)-6-hydroxy-4-methyl-2-(phenylmethylene)-7-(1-pyrrolidinylmethyl)-3-benzofuranone IUPAC Name: (2Z)-2-benzylidene-6-hydroxy-4-methyl-7-(pyrrolidin-1-ylmethyl)-1-benzofuran-3-one Traditional Name: (2Z)-2-benzal-6-hydroxy-4-methyl-7-(pyrrolidinomethyl)coumaran-3-one Formula: C21H21NO3 MolecularWeight: 335.39634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C2=C1C(=O)C(=CC3=CC=CC=C3)O2)CN4CCCC4)O

Isomeric SMILES

CC1=CC(=C(C2=C1C(=O)/C(=C/C3=CC=CC=C3)/O2)CN4CCCC4)O

InChI

InChI=1S/C21H21NO3/c1-14-11-17(23)16(13-22-9-5-6-10-22)21-19(14)20(24)18(25-21)12-15-7-3-2-4-8-15/h2-4,7-8,11-12,23H,5-6,9-10,13H2,1H3/b18-12-