4-methoxy-3-(2-methylbutoxy)benzaldehyde; (2Z)-2-[[4-methoxy-3-(2-methylbutoxy)phenyl]methylidene]-1-azabicyclo[2.2.2]octan-3-one

Systemtic Name: 4-methoxy-3-(2-methylbutoxy)benzaldehyde; (2Z)-2-[[4-methoxy-3-(2-methylbutoxy)phenyl]methylidene]-1-azabicyclo[2.2.2]octan-3-one Openeye Name: 4-methoxy-3-(2-methylbutoxy)benzaldehyde; (2Z)-2-[[4-methoxy-3-(2-methylbutoxy)phenyl]methylene]quinuclidin-3-one CAS Name: 4-methoxy-3-(2-methylbutoxy)benzaldehyde; (2Z)-2-[[4-methoxy-3-(2-methylbutoxy)phenyl]methylidene]-1-azabicyclo[2.2.2]octan-3-one IUPAC Name: 4-methoxy-3-(2-methylbutoxy)benzaldehyde; (2Z)-2-[[4-methoxy-3-(2-methylbutoxy)phenyl]methylidene]-1-azabicyclo[2.2.2]octan-3-one Traditional Name: 4-methoxy-3-(2-methylbutoxy)benzaldehyde; (2Z)-2-[4-methoxy-3-(2-methylbutoxy)benzylidene]quinuclidin-3-one Formula: C33H45NO6 MolecularWeight: 551.7135

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H27NO3.C13H18O3/c1-4-14(2)13-24-19-12-15(5-6-18(19)23-3)11-17-20(22)16-7-9-21(17)10-8-16;1-4-10(2)9-16-13-7-11(8-14)5-6-12(13)15-3/h5-6,11-12,14,16H,4,7-10,13H2,1-3H3;5-8,10H,4,9H2,1-3H3/b17-11-;