(2Z)-2-[(2,3-dimethoxyphenyl)methylidene]-6-oxidanyl-7-(piperidin-1-ium-1-ylmethyl)-1-benzofuran-3-one

Systemtic Name: (2Z)-2-[(2,3-dimethoxyphenyl)methylidene]-6-oxidanyl-7-(piperidin-1-ium-1-ylmethyl)-1-benzofuran-3-one Openeye Name: (2Z)-2-[(2,3-dimethoxyphenyl)methylene]-6-hydroxy-7-(piperidin-1-ium-1-ylmethyl)benzofuran-3-one CAS Name: (2Z)-2-[(2,3-dimethoxyphenyl)methylidene]-6-hydroxy-7-(1-piperidin-1-iumylmethyl)-3-benzofuranone IUPAC Name: (2Z)-2-[(2,3-dimethoxyphenyl)methylidene]-6-hydroxy-7-(piperidin-1-ium-1-ylmethyl)-1-benzofuran-3-one Traditional Name: (2Z)-2-(2,3-dimethoxybenzylidene)-6-hydroxy-7-(piperidin-1-ium-1-ylmethyl)coumaran-3-one Formula: C23H26NO5+ MolecularWeight: 396.45624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C=C2C(=O)C3=C(O2)C(=C(C=C3)O)C[NH+]4CCCCC4

Isomeric SMILES

COC1=CC=CC(=C1OC)/C=C\2/C(=O)C3=C(O2)C(=C(C=C3)O)C[NH+]4CCCCC4

InChI

InChI=1S/C23H25NO5/c1-27-19-8-6-7-15(22(19)28-2)13-20-21(26)16-9-10-18(25)17(23(16)29-20)14-24-11-4-3-5-12-24/h6-10,13,25H,3-5,11-12,14H2,1-2H3/p+1/b20-13-