5,7,7-trimethyloctyl 3,5,5-trimethyl-2-methylidene-hexanoate

Systemtic Name: 5,7,7-trimethyloctyl 3,5,5-trimethyl-2-methylidene-hexanoate Openeye Name: 5,7,7-trimethyloctyl 3,5,5-trimethyl-2-methylene-hexanoate CAS Name: 3,5,5-trimethyl-2-methylenehexanoic acid 5,7,7-trimethyloctyl ester IUPAC Name: 5,7,7-trimethyloctyl 3,5,5-trimethyl-2-methylidenehexanoate Traditional Name: 2-(1,3,3-trimethylbutyl)acrylic acid 5,7,7-trimethyloctyl ester Formula: C21H40O2 MolecularWeight: 324.5411

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCOC(=O)C(=C)C(C)CC(C)(C)C)CC(C)(C)C

Isomeric SMILES

CC(CCCCOC(=O)C(=C)C(C)CC(C)(C)C)CC(C)(C)C

InChI

InChI=1S/C21H40O2/c1-16(14-20(4,5)6)12-10-11-13-23-19(22)18(3)17(2)15-21(7,8)9/h16-17H,3,10-15H2,1-2,4-9H3