2-[[2-[2-(3,4-diethoxyphenyl)ethanoyl]-5,5-dimethyl-3-oxidanylidene-cyclohexylidene]amino]ethanoate

Systemtic Name: 2-[[2-[2-(3,4-diethoxyphenyl)ethanoyl]-5,5-dimethyl-3-oxidanylidene-cyclohexylidene]amino]ethanoate Openeye Name: 2-[[2-[2-(3,4-diethoxyphenyl)acetyl]-5,5-dimethyl-3-oxo-cyclohexylidene]amino]acetate CAS Name: 2-[[2-[2-(3,4-diethoxyphenyl)-1-oxoethyl]-5,5-dimethyl-3-oxocyclohexylidene]amino]acetate IUPAC Name: 2-[[2-[2-(3,4-diethoxyphenyl)acetyl]-5,5-dimethyl-3-oxocyclohexylidene]amino]acetate Traditional Name: 2-[[2-[2-(3,4-diethoxyphenyl)acetyl]-3-keto-5,5-dimethyl-cyclohexylidene]amino]acetate Formula: C22H28NO6- MolecularWeight: 402.46082

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CC(=O)C2C(=NCC(=O)[O-])CC(CC2=O)(C)C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CC(=O)C2C(=NCC(=O)[O-])CC(CC2=O)(C)C)OCC

InChI

InChI=1S/C22H29NO6/c1-5-28-18-8-7-14(10-19(18)29-6-2)9-16(24)21-15(23-13-20(26)27)11-22(3,4)12-17(21)25/h7-8,10,21H,5-6,9,11-13H2,1-4H3,(H,26,27)/p-1