(3Z,5E)-1-ethyl-3,5-bis[(4-methoxy-3-oxidanyl-phenyl)methylidene]piperidin-1-ium-4-one

Systemtic Name: (3Z,5E)-1-ethyl-3,5-bis[(4-methoxy-3-oxidanyl-phenyl)methylidene]piperidin-1-ium-4-one Openeye Name: (3Z,5E)-1-ethyl-3,5-bis[(3-hydroxy-4-methoxy-phenyl)methylene]piperidin-1-ium-4-one CAS Name: (3Z,5E)-1-ethyl-3,5-bis[(3-hydroxy-4-methoxyphenyl)methylidene]-4-piperidin-1-iumone IUPAC Name: (3Z,5E)-1-ethyl-3,5-bis[(3-hydroxy-4-methoxyphenyl)methylidene]piperidin-1-ium-4-one Traditional Name: (3Z,5E)-1-ethyl-3,5-bis(3-hydroxy-4-methoxy-benzylidene)piperidin-1-ium-4-one Formula: C23H26NO5+ MolecularWeight: 396.45624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CC(=CC2=CC(=C(C=C2)OC)O)C(=O)C(=CC3=CC(=C(C=C3)OC)O)C1

Isomeric SMILES

CC[NH+]1C/C(=C\C2=CC(=C(C=C2)OC)O)/C(=O)/C(=C\C3=CC(=C(C=C3)OC)O)/C1

InChI

InChI=1S/C23H25NO5/c1-4-24-13-17(9-15-5-7-21(28-2)19(25)11-15)23(27)18(14-24)10-16-6-8-22(29-3)20(26)12-16/h5-12,25-26H,4,13-14H2,1-3H3/p+1/b17-9-,18-10+