pentyl 5-methyl-5-[4-(2-methyl-6-oxidanylidene-6-pentoxy-hexan-2-yl)-3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]hexanoate

Systemtic Name: pentyl 5-methyl-5-[4-(2-methyl-6-oxidanylidene-6-pentoxy-hexan-2-yl)-3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]hexanoate Openeye Name: pentyl 5-[4-(1,1-dimethyl-5-oxo-5-pentoxy-pentyl)-3,6-dioxo-cyclohexa-1,4-dien-1-yl]-5-methyl-hexanoate CAS Name: 5-methyl-5-[4-(2-methyl-6-oxo-6-pentoxyhexan-2-yl)-3,6-dioxo-1-cyclohexa-1,4-dienyl]hexanoic acid pentyl ester IUPAC Name: pentyl 5-methyl-5-[4-(2-methyl-6-oxo-6-pentoxyhexan-2-yl)-3,6-dioxocyclohexa-1,4-dien-1-yl]hexanoate Traditional Name: 5-[4-(5-amoxy-5-keto-1,1-dimethyl-pentyl)-3,6-diketo-cyclohexa-1,4-dien-1-yl]-5-methyl-hexanoic acid amyl ester Formula: C30H48O6 MolecularWeight: 504.69852

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)CCCC(C)(C)C1=CC(=O)C(=CC1=O)C(C)(C)CCCC(=O)OCCCCC

Isomeric SMILES

CCCCCOC(=O)CCCC(C)(C)C1=CC(=O)C(=CC1=O)C(C)(C)CCCC(=O)OCCCCC

InChI

InChI=1S/C30H48O6/c1-7-9-11-19-35-27(33)15-13-17-29(3,4)23-21-26(32)24(22-25(23)31)30(5,6)18-14-16-28(34)36-20-12-10-8-2/h21-22H,7-20H2,1-6H3