[2-(4,4-dimethylpentan-2-yl)-4-ethyl-6,6-dimethyl-heptyl] prop-2-enoate

Systemtic Name: [2-(4,4-dimethylpentan-2-yl)-4-ethyl-6,6-dimethyl-heptyl] prop-2-enoate Openeye Name: [4-ethyl-6,6-dimethyl-2-(1,3,3-trimethylbutyl)heptyl] prop-2-enoate CAS Name: 2-propenoic acid [2-(4,4-dimethylpentan-2-yl)-4-ethyl-6,6-dimethylheptyl] ester IUPAC Name: [2-(4,4-dimethylpentan-2-yl)-4-ethyl-6,6-dimethylheptyl] prop-2-enoate Traditional Name: acrylic acid [4-ethyl-6,6-dimethyl-2-(1,3,3-trimethylbutyl)heptyl] ester Formula: C21H40O2 MolecularWeight: 324.5411

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(COC(=O)C=C)C(C)CC(C)(C)C)CC(C)(C)C

Isomeric SMILES

CCC(CC(COC(=O)C=C)C(C)CC(C)(C)C)CC(C)(C)C

InChI

InChI=1S/C21H40O2/c1-10-17(14-21(7,8)9)12-18(15-23-19(22)11-2)16(3)13-20(4,5)6/h11,16-18H,2,10,12-15H2,1,3-9H3