(2Z)-2-(furan-2-ylmethylidene)-7-[[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl]-6-oxidanyl-1-benzofuran-3-one

Systemtic Name: (2Z)-2-(furan-2-ylmethylidene)-7-[[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl]-6-oxidanyl-1-benzofuran-3-one Openeye Name: (2Z)-2-(2-furylmethylene)-6-hydroxy-7-[[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl]benzofuran-3-one CAS Name: (2Z)-2-(2-furanylmethylidene)-6-hydroxy-7-[[4-(2-hydroxyethyl)-1-piperazin-1-iumyl]methyl]-3-benzofuranone IUPAC Name: (2Z)-2-(furan-2-ylmethylidene)-6-hydroxy-7-[[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl]-1-benzofuran-3-one Traditional Name: (2Z)-2-(2-furfurylidene)-6-hydroxy-7-[[4-(2-hydroxyethyl)piperazin-1-ium-1-yl]methyl]coumaran-3-one Formula: C20H23N2O5+ MolecularWeight: 371.40702

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=C(C=CC3=C2OC(=CC4=CC=CO4)C3=O)O)CCO

Isomeric SMILES

C1CN(CC[NH+]1CC2=C(C=CC3=C2O/C(=C\C4=CC=CO4)/C3=O)O)CCO

InChI

InChI=1S/C20H22N2O5/c23-10-9-21-5-7-22(8-6-21)13-16-17(24)4-3-15-19(25)18(27-20(15)16)12-14-2-1-11-26-14/h1-4,11-12,23-24H,5-10,13H2/p+1/b18-12-