(2Z)-7-[(4-ethylpiperazine-1,4-diium-1-yl)methyl]-2-[(5-methylfuran-2-yl)methylidene]-6-oxidanyl-1-benzofuran-3-one

Systemtic Name: (2Z)-7-[(4-ethylpiperazine-1,4-diium-1-yl)methyl]-2-[(5-methylfuran-2-yl)methylidene]-6-oxidanyl-1-benzofuran-3-one Openeye Name: (2Z)-7-[(4-ethylpiperazine-1,4-diium-1-yl)methyl]-6-hydroxy-2-[(5-methyl-2-furyl)methylene]benzofuran-3-one CAS Name: (2Z)-7-[(4-ethyl-1-piperazine-1,4-diiumyl)methyl]-6-hydroxy-2-[(5-methyl-2-furanyl)methylidene]-3-benzofuranone IUPAC Name: (2Z)-7-[(4-ethylpiperazine-1,4-diium-1-yl)methyl]-6-hydroxy-2-[(5-methylfuran-2-yl)methylidene]-1-benzofuran-3-one Traditional Name: (2Z)-7-[(4-ethylpiperazine-1,4-diium-1-yl)methyl]-6-hydroxy-2-[(5-methyl-2-furyl)methylene]coumaran-3-one Formula: C21H26N2O4+2 MolecularWeight: 370.44214

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CC[NH+](CC1)CC2=C(C=CC3=C2OC(=CC4=CC=C(O4)C)C3=O)O

Isomeric SMILES

CC[NH+]1CC[NH+](CC1)CC2=C(C=CC3=C2O/C(=C\C4=CC=C(O4)C)/C3=O)O

InChI

InChI=1S/C21H24N2O4/c1-3-22-8-10-23(11-9-22)13-17-18(24)7-6-16-20(25)19(27-21(16)17)12-15-5-4-14(2)26-15/h4-7,12,24H,3,8-11,13H2,1-2H3/p+2/b19-12-