butyl (E)-3-methyl-3-oxidanyl-5-(2,6,6-trimethylcyclohex-2-en-1-yl)pent-4-enoate

Systemtic Name: butyl (E)-3-methyl-3-oxidanyl-5-(2,6,6-trimethylcyclohex-2-en-1-yl)pent-4-enoate Openeye Name: butyl (E)-3-hydroxy-3-methyl-5-(2,6,6-trimethylcyclohex-2-en-1-yl)pent-4-enoate CAS Name: (E)-3-hydroxy-3-methyl-5-(2,6,6-trimethyl-1-cyclohex-2-enyl)-4-pentenoic acid butyl ester IUPAC Name: butyl (E)-3-hydroxy-3-methyl-5-(2,6,6-trimethylcyclohex-2-en-1-yl)pent-4-enoate Traditional Name: (E)-3-hydroxy-3-methyl-5-(2,6,6-trimethylcyclohex-2-en-1-yl)pent-4-enoic acid butyl ester Formula: C19H32O3 MolecularWeight: 308.45558

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CC(C)(C=CC1C(=CCCC1(C)C)C)O

Isomeric SMILES

CCCCOC(=O)CC(C)(/C=C/C1C(=CCCC1(C)C)C)O

InChI

InChI=1S/C19H32O3/c1-6-7-13-22-17(20)14-19(5,21)12-10-16-15(2)9-8-11-18(16,3)4/h9-10,12,16,21H,6-8,11,13-14H2,1-5H3/b12-10+