(2Z)-7-(1-methylpiperidin-4-yl)-4,6-bis(oxidanyl)-2-(phenylmethylidene)-1-benzofuran-3-one

Systemtic Name: (2Z)-7-(1-methylpiperidin-4-yl)-4,6-bis(oxidanyl)-2-(phenylmethylidene)-1-benzofuran-3-one Openeye Name: (2Z)-2-benzylidene-4,6-dihydroxy-7-(1-methyl-4-piperidyl)benzofuran-3-one CAS Name: (2Z)-4,6-dihydroxy-7-(1-methyl-4-piperidinyl)-2-(phenylmethylene)-3-benzofuranone IUPAC Name: (2Z)-2-benzylidene-4,6-dihydroxy-7-(1-methylpiperidin-4-yl)-1-benzofuran-3-one Traditional Name: (2Z)-2-benzal-4,6-dihydroxy-7-(1-methyl-4-piperidyl)coumaran-3-one Formula: C21H21NO4 MolecularWeight: 351.39574

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)C2=C(C=C(C3=C2OC(=CC4=CC=CC=C4)C3=O)O)O

Isomeric SMILES

CN1CCC(CC1)C2=C(C=C(C3=C2O/C(=C\C4=CC=CC=C4)/C3=O)O)O

InChI

InChI=1S/C21H21NO4/c1-22-9-7-14(8-10-22)18-15(23)12-16(24)19-20(25)17(26-21(18)19)11-13-5-3-2-4-6-13/h2-6,11-12,14,23-24H,7-10H2,1H3/b17-11-