(2Z)-2-(furan-2-ylmethylidene)-7-[(4-methylpiperazine-1,4-diium-1-yl)methyl]-6-oxidanyl-1-benzofuran-3-one

Systemtic Name: (2Z)-2-(furan-2-ylmethylidene)-7-[(4-methylpiperazine-1,4-diium-1-yl)methyl]-6-oxidanyl-1-benzofuran-3-one Openeye Name: (2Z)-2-(2-furylmethylene)-6-hydroxy-7-[(4-methylpiperazine-1,4-diium-1-yl)methyl]benzofuran-3-one CAS Name: (2Z)-2-(2-furanylmethylidene)-6-hydroxy-7-[(4-methyl-1-piperazine-1,4-diiumyl)methyl]-3-benzofuranone IUPAC Name: (2Z)-2-(furan-2-ylmethylidene)-6-hydroxy-7-[(4-methylpiperazine-1,4-diium-1-yl)methyl]-1-benzofuran-3-one Traditional Name: (2Z)-2-(2-furfurylidene)-6-hydroxy-7-[(4-methylpiperazine-1,4-diium-1-yl)methyl]coumaran-3-one Formula: C19H22N2O4+2 MolecularWeight: 342.38898

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](CC1)CC2=C(C=CC3=C2OC(=CC4=CC=CO4)C3=O)O

Isomeric SMILES

C[NH+]1CC[NH+](CC1)CC2=C(C=CC3=C2O/C(=C\C4=CC=CO4)/C3=O)O

InChI

InChI=1S/C19H20N2O4/c1-20-6-8-21(9-7-20)12-15-16(22)5-4-14-18(23)17(25-19(14)15)11-13-3-2-10-24-13/h2-5,10-11,22H,6-9,12H2,1H3/p+2/b17-11-