tert-butyl (2E,3E,5E,7E)-2-ethylidene-4-methyl-9-oxidanylidene-nona-3,5,7-trienoate

Systemtic Name: tert-butyl (2E,3E,5E,7E)-2-ethylidene-4-methyl-9-oxidanylidene-nona-3,5,7-trienoate Openeye Name: tert-butyl (2E,3E,5E,7E)-2-ethylidene-4-methyl-9-oxo-nona-3,5,7-trienoate CAS Name: (2E,3E,5E,7E)-2-ethylidene-4-methyl-9-oxonona-3,5,7-trienoic acid tert-butyl ester IUPAC Name: tert-butyl (2E,3E,5E,7E)-2-ethylidene-4-methyl-9-oxonona-3,5,7-trienoate Traditional Name: (2E,3E,5E,7E)-2-ethylidene-9-keto-4-methyl-nona-3,5,7-trienoic acid tert-butyl ester Formula: C16H22O3 MolecularWeight: 262.34408

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Descriptors Computed from Structure

Canonical SMILES:

CC=C(C=C(C)C=CC=CC=O)C(=O)OC(C)(C)C

Isomeric SMILES

C/C=C(\C=C(/C)\C=C\C=C\C=O)/C(=O)OC(C)(C)C

InChI

InChI=1S/C16H22O3/c1-6-14(15(18)19-16(3,4)5)12-13(2)10-8-7-9-11-17/h6-12H,1-5H3/b9-7+,10-8+,13-12+,14-6+