[(6Z)-6-[(3,4-dimethoxyphenyl)methylidene]-1-imidazolidin-2-yl-7-oxidanylidene-octan-3-yl] 2-oxidanylidenepropanoate

Systemtic Name: [(6Z)-6-[(3,4-dimethoxyphenyl)methylidene]-1-imidazolidin-2-yl-7-oxidanylidene-octan-3-yl] 2-oxidanylidenepropanoate Openeye Name: [(4Z)-4-[(3,4-dimethoxyphenyl)methylene]-1-(2-imidazolidin-2-ylethyl)-5-oxo-hexyl] 2-oxopropanoate CAS Name: 2-oxopropanoic acid [(6Z)-6-[(3,4-dimethoxyphenyl)methylidene]-1-(2-imidazolidinyl)-7-oxooctan-3-yl] ester IUPAC Name: [(6Z)-6-[(3,4-dimethoxyphenyl)methylidene]-1-imidazolidin-2-yl-7-oxooctan-3-yl] 2-oxopropanoate Traditional Name: 2-ketopropionic acid [(Z)-4-acetyl-5-(3,4-dimethoxyphenyl)-1-(2-imidazolidin-2-ylethyl)pent-4-enyl] ester Formula: C23H32N2O6 MolecularWeight: 432.50998

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CC1=CC(=C(C=C1)OC)OC)CCC(CCC2NCCN2)OC(=O)C(=O)C

Isomeric SMILES

CC(=O)/C(=C\C1=CC(=C(C=C1)OC)OC)/CCC(CCC2NCCN2)OC(=O)C(=O)C

InChI

InChI=1S/C23H32N2O6/c1-15(26)18(13-17-5-9-20(29-3)21(14-17)30-4)6-7-19(31-23(28)16(2)27)8-10-22-24-11-12-25-22/h5,9,13-14,19,22,24-25H,6-8,10-12H2,1-4H3/b18-13-