4-methoxy-2,6-bis(oxidanyl)benzaldehyde; (2Z)-2-[[4-methoxy-2,6-bis(oxidanyl)phenyl]methylidene]-1-azabicyclo[2.2.2]octan-3-one

Systemtic Name: 4-methoxy-2,6-bis(oxidanyl)benzaldehyde; (2Z)-2-[[4-methoxy-2,6-bis(oxidanyl)phenyl]methylidene]-1-azabicyclo[2.2.2]octan-3-one Openeye Name: 2,6-dihydroxy-4-methoxy-benzaldehyde; (2Z)-2-[(2,6-dihydroxy-4-methoxy-phenyl)methylene]quinuclidin-3-one CAS Name: 2,6-dihydroxy-4-methoxybenzaldehyde; (2Z)-2-[(2,6-dihydroxy-4-methoxyphenyl)methylidene]-1-azabicyclo[2.2.2]octan-3-one IUPAC Name: 2,6-dihydroxy-4-methoxybenzaldehyde; (2Z)-2-[(2,6-dihydroxy-4-methoxyphenyl)methylidene]-1-azabicyclo[2.2.2]octan-3-one Traditional Name: 2,6-dihydroxy-4-methoxy-benzaldehyde; (2Z)-2-(2,6-dihydroxy-4-methoxy-benzylidene)quinuclidin-3-one Formula: C23H25NO8 MolecularWeight: 443.4465

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C(=C1)O)C=C2C(=O)C3CCN2CC3)O.COC1=CC(=C(C(=C1)O)C=O)O

Isomeric SMILES

COC1=CC(=C(C(=C1)O)/C=C\2/C(=O)C3CCN2CC3)O.COC1=CC(=C(C(=C1)O)C=O)O

InChI

InChI=1S/C15H17NO4.C8H8O4/c1-20-10-6-13(17)11(14(18)7-10)8-12-15(19)9-2-4-16(12)5-3-9;1-12-5-2-7(10)6(4-9)8(11)3-5/h6-9,17-18H,2-5H2,1H3;2-4,10-11H,1H3/b12-8-;