[3-(2-ethylhexanoyloxy)-2,2,4,4-tetramethyl-cyclobutyl] nonanoate

Systemtic Name: [3-(2-ethylhexanoyloxy)-2,2,4,4-tetramethyl-cyclobutyl] nonanoate Openeye Name: [3-(2-ethylhexanoyloxy)-2,2,4,4-tetramethyl-cyclobutyl] nonanoate CAS Name: nonanoic acid [3-(2-ethyl-1-oxohexoxy)-2,2,4,4-tetramethylcyclobutyl] ester IUPAC Name: [3-(2-ethylhexanoyloxy)-2,2,4,4-tetramethylcyclobutyl] nonanoate Traditional Name: pelargonic acid [3-(2-ethylhexanoyloxy)-2,2,4,4-tetramethyl-cyclobutyl] ester Formula: C25H46O4 MolecularWeight: 410.63034

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=O)OC1C(C(C1(C)C)OC(=O)C(CC)CCCC)(C)C

Isomeric SMILES

CCCCCCCCC(=O)OC1C(C(C1(C)C)OC(=O)C(CC)CCCC)(C)C

InChI

InChI=1S/C25H46O4/c1-8-11-13-14-15-16-18-20(26)28-22-24(4,5)23(25(22,6)7)29-21(27)19(10-3)17-12-9-2/h19,22-23H,8-18H2,1-7H3