tert-butyl 4-[5-cyano-4-(dimethoxymethyl)-6-ethoxy-6-oxidanylidene-hexyl]benzoate

Systemtic Name: tert-butyl 4-[5-cyano-4-(dimethoxymethyl)-6-ethoxy-6-oxidanylidene-hexyl]benzoate Openeye Name: tert-butyl 4-[5-cyano-4-(dimethoxymethyl)-6-ethoxy-6-oxo-hexyl]benzoate CAS Name: 4-[5-cyano-4-(dimethoxymethyl)-6-ethoxy-6-oxohexyl]benzoic acid tert-butyl ester IUPAC Name: tert-butyl 4-[5-cyano-4-(dimethoxymethyl)-6-ethoxy-6-oxohexyl]benzoate Traditional Name: 4-[5-cyano-4-(dimethoxymethyl)-6-ethoxy-6-keto-hexyl]benzoic acid tert-butyl ester Formula: C23H33NO6 MolecularWeight: 419.51122

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C#N)C(CCCC1=CC=C(C=C1)C(=O)OC(C)(C)C)C(OC)OC

Isomeric SMILES

CCOC(=O)C(C#N)C(CCCC1=CC=C(C=C1)C(=O)OC(C)(C)C)C(OC)OC

InChI

InChI=1S/C23H33NO6/c1-7-29-21(26)19(15-24)18(22(27-5)28-6)10-8-9-16-11-13-17(14-12-16)20(25)30-23(2,3)4/h11-14,18-19,22H,7-10H2,1-6H3