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

Systemtic Name: heptyl 5-[4-(6-heptoxy-2-methyl-6-oxidanylidene-hexan-2-yl)-3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]-5-methyl-hexanoate Openeye Name: heptyl 5-[4-(5-heptoxy-1,1-dimethyl-5-oxo-pentyl)-3,6-dioxo-cyclohexa-1,4-dien-1-yl]-5-methyl-hexanoate CAS Name: 5-[4-(6-heptoxy-2-methyl-6-oxohexan-2-yl)-3,6-dioxo-1-cyclohexa-1,4-dienyl]-5-methylhexanoic acid heptyl ester IUPAC Name: heptyl 5-[4-(6-heptoxy-2-methyl-6-oxohexan-2-yl)-3,6-dioxocyclohexa-1,4-dien-1-yl]-5-methylhexanoate Traditional Name: 5-[4-(5-heptoxy-5-keto-1,1-dimethyl-pentyl)-3,6-diketo-cyclohexa-1,4-dien-1-yl]-5-methyl-hexanoic acid heptyl ester Formula: C34H56O6 MolecularWeight: 560.80484

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)CCCC(C)(C)C1=CC(=O)C(=CC1=O)C(C)(C)CCCC(=O)OCCCCCCC

Isomeric SMILES

CCCCCCCOC(=O)CCCC(C)(C)C1=CC(=O)C(=CC1=O)C(C)(C)CCCC(=O)OCCCCCCC

InChI

InChI=1S/C34H56O6/c1-7-9-11-13-15-23-39-31(37)19-17-21-33(3,4)27-25-30(36)28(26-29(27)35)34(5,6)22-18-20-32(38)40-24-16-14-12-10-8-2/h25-26H,7-24H2,1-6H3