O1-butyl O7-tert-butyl 6-ethyl-2,2-dimethyl-heptanedioate

Systemtic Name: O1-butyl O7-tert-butyl 6-ethyl-2,2-dimethyl-heptanedioate Openeye Name: O1-butyl O7-tert-butyl 6-ethyl-2,2-dimethyl-heptanedioate CAS Name: 6-ethyl-2,2-dimethylheptanedioic acid O1-butyl ester O7-tert-butyl ester IUPAC Name: 1-O-butyl 7-O-tert-butyl 6-ethyl-2,2-dimethylheptanedioate Traditional Name: 6-ethyl-2,2-dimethyl-pimelic acid O1-butyl ester O7-tert-butyl ester Formula: C19H36O4 MolecularWeight: 328.48674

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(C)(C)CCCC(CC)C(=O)OC(C)(C)C

Isomeric SMILES

CCCCOC(=O)C(C)(C)CCCC(CC)C(=O)OC(C)(C)C

InChI

InChI=1S/C19H36O4/c1-8-10-14-22-17(21)19(6,7)13-11-12-15(9-2)16(20)23-18(3,4)5/h15H,8-14H2,1-7H3