ethyl (E)-4,4-dideuterio-2-methyl-4-(2,6,6-trimethylcyclohexen-1-yl)but-2-enoate

Systemtic Name: ethyl (E)-4,4-dideuterio-2-methyl-4-(2,6,6-trimethylcyclohexen-1-yl)but-2-enoate Openeye Name: ethyl (E)-4,4-dideuterio-2-methyl-4-(2,6,6-trimethylcyclohexen-1-yl)but-2-enoate CAS Name: (E)-4,4-dideuterio-2-methyl-4-(2,6,6-trimethyl-1-cyclohexenyl)-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-4,4-dideuterio-2-methyl-4-(2,6,6-trimethylcyclohexen-1-yl)but-2-enoate Traditional Name: (E)-4,4-dideuterio-2-methyl-4-(2,6,6-trimethylcyclohexen-1-yl)but-2-enoic acid ethyl ester Formula: C16H26O2 MolecularWeight: 252.388764

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CCC1=C(CCCC1(C)C)C)C

Isomeric SMILES

[2H]C([2H])(/C=C(\C)/C(=O)OCC)C1=C(CCCC1(C)C)C

InChI

InChI=1S/C16H26O2/c1-6-18-15(17)13(3)9-10-14-12(2)8-7-11-16(14,4)5/h9H,6-8,10-11H2,1-5H3/b13-9+/i10D2