tert-butyl 5-acetyloxy-2-(4-cyanophenyl)carbonyl-3-[4-(2-ethoxy-2-oxidanylidene-ethoxy)phenyl]carbonyl-pentanoate

Systemtic Name: tert-butyl 5-acetyloxy-2-(4-cyanophenyl)carbonyl-3-[4-(2-ethoxy-2-oxidanylidene-ethoxy)phenyl]carbonyl-pentanoate Openeye Name: tert-butyl 5-acetoxy-2-(4-cyanobenzoyl)-3-[4-(2-ethoxy-2-oxo-ethoxy)benzoyl]pentanoate CAS Name: 5-acetyloxy-2-[(4-cyanophenyl)-oxomethyl]-3-[[4-(2-ethoxy-2-oxoethoxy)phenyl]-oxomethyl]pentanoic acid tert-butyl ester IUPAC Name: tert-butyl 5-acetyloxy-2-(4-cyanobenzoyl)-3-[4-(2-ethoxy-2-oxoethoxy)benzoyl]pentanoate Traditional Name: 5-acetoxy-2-(4-cyanobenzoyl)-3-[4-(2-ethoxy-2-keto-ethoxy)benzoyl]valeric acid tert-butyl ester Formula: C30H33NO9 MolecularWeight: 551.58432

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COC1=CC=C(C=C1)C(=O)C(CCOC(=O)C)C(C(=O)C2=CC=C(C=C2)C#N)C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)COC1=CC=C(C=C1)C(=O)C(CCOC(=O)C)C(C(=O)C2=CC=C(C=C2)C#N)C(=O)OC(C)(C)C

InChI

InChI=1S/C30H33NO9/c1-6-37-25(33)18-39-23-13-11-21(12-14-23)27(34)24(15-16-38-19(2)32)26(29(36)40-30(3,4)5)28(35)22-9-7-20(17-31)8-10-22/h7-14,24,26H,6,15-16,18H2,1-5H3