tert-butyl 3-[5-(3-methoxy-3-oxidanylidene-propyl)-2,4-dimethyl-3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]-3-methyl-butanoate

Systemtic Name: tert-butyl 3-[5-(3-methoxy-3-oxidanylidene-propyl)-2,4-dimethyl-3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]-3-methyl-butanoate Openeye Name: tert-butyl 3-[5-(3-methoxy-3-oxo-propyl)-2,4-dimethyl-3,6-dioxo-cyclohexa-1,4-dien-1-yl]-3-methyl-butanoate CAS Name: 3-[5-(3-methoxy-3-oxopropyl)-2,4-dimethyl-3,6-dioxo-1-cyclohexa-1,4-dienyl]-3-methylbutanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-[5-(3-methoxy-3-oxopropyl)-2,4-dimethyl-3,6-dioxocyclohexa-1,4-dien-1-yl]-3-methylbutanoate Traditional Name: 3-[3,6-diketo-5-(3-keto-3-methoxy-propyl)-2,4-dimethyl-cyclohexa-1,4-dien-1-yl]-3-methyl-butyric acid tert-butyl ester Formula: C21H30O6 MolecularWeight: 378.4593

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H30O6/c1-12-14(9-10-15(22)26-8)19(25)17(13(2)18(12)24)21(6,7)11-16(23)27-20(3,4)5/h9-11H2,1-8H3