[(1S,2S,4E,5S)-4-(methoxymethylidene)-2-methyl-5-prop-2-enyl-cyclohexyl]methoxymethylbenzene

Systemtic Name: [(1S,2S,4E,5S)-4-(methoxymethylidene)-2-methyl-5-prop-2-enyl-cyclohexyl]methoxymethylbenzene Openeye Name: [(1S,2S,4E,5S)-5-allyl-4-(methoxymethylene)-2-methyl-cyclohexyl]methoxymethylbenzene CAS Name: [(1S,2S,4E,5S)-4-(methoxymethylidene)-2-methyl-5-prop-2-enylcyclohexyl]methoxymethylbenzene IUPAC Name: [(1S,2S,4E,5S)-4-(methoxymethylidene)-2-methyl-5-prop-2-enylcyclohexyl]methoxymethylbenzene Traditional Name: [(1S,2S,4E,5S)-5-allyl-4-(methoxymethylene)-2-methyl-cyclohexyl]methoxymethylbenzene Formula: C20H28O2 MolecularWeight: 300.43512

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=COC)C(CC1COCC2=CC=CC=C2)CC=C

Isomeric SMILES

C[C@H]1C/C(=C\OC)/[C@H](C[C@@H]1COCC2=CC=CC=C2)CC=C

InChI

InChI=1S/C20H28O2/c1-4-8-18-12-19(16(2)11-20(18)14-21-3)15-22-13-17-9-6-5-7-10-17/h4-7,9-10,14,16,18-19H,1,8,11-13,15H2,2-3H3/b20-14+/t16-,18-,19+/m0/s1