[(1S)-4-[(E,3R)-3-acetyloxybut-1-enyl]-3,5,5-trimethyl-cyclohex-3-en-1-yl] ethanoate

Systemtic Name: [(1S)-4-[(E,3R)-3-acetyloxybut-1-enyl]-3,5,5-trimethyl-cyclohex-3-en-1-yl] ethanoate Openeye Name: [(1S)-4-[(E,3R)-3-acetoxybut-1-enyl]-3,5,5-trimethyl-cyclohex-3-en-1-yl] acetate CAS Name: acetic acid [(1S)-4-[(E,3R)-3-acetyloxybut-1-enyl]-3,5,5-trimethyl-1-cyclohex-3-enyl] ester IUPAC Name: [(1S)-4-[(E,3R)-3-acetyloxybut-1-enyl]-3,5,5-trimethylcyclohex-3-en-1-yl] acetate Traditional Name: acetic acid [(1S)-4-[(E,3R)-3-acetoxybut-1-enyl]-3,5,5-trimethyl-cyclohex-3-en-1-yl] ester Formula: C17H26O4 MolecularWeight: 294.38594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CC(C1)OC(=O)C)(C)C)C=CC(C)OC(=O)C

Isomeric SMILES

CC1=C(C(C[C@H](C1)OC(=O)C)(C)C)/C=C/[C@@H](C)OC(=O)C

InChI

InChI=1S/C17H26O4/c1-11-9-15(21-14(4)19)10-17(5,6)16(11)8-7-12(2)20-13(3)18/h7-8,12,15H,9-10H2,1-6H3/b8-7+/t12-,15+/m1/s1