(1R,6S)-2,2,4-trimethyl-3-(phenylmethoxymethyl)-6-propyl-cyclohex-3-ene-1-carbaldehyde

Systemtic Name: (1R,6S)-2,2,4-trimethyl-3-(phenylmethoxymethyl)-6-propyl-cyclohex-3-ene-1-carbaldehyde Openeye Name: (1R,6S)-3-(benzyloxymethyl)-2,2,4-trimethyl-6-propyl-cyclohex-3-ene-1-carbaldehyde CAS Name: (1R,6S)-2,2,4-trimethyl-3-(phenylmethoxymethyl)-6-propyl-1-cyclohex-3-enecarboxaldehyde IUPAC Name: (1R,6S)-2,2,4-trimethyl-3-(phenylmethoxymethyl)-6-propylcyclohex-3-ene-1-carbaldehyde Traditional Name: (1R,6S)-3-(benzoxymethyl)-2,2,4-trimethyl-6-propyl-cyclohex-3-ene-1-carbaldehyde Formula: C21H30O2 MolecularWeight: 314.4617

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CC(=C(C(C1C=O)(C)C)COCC2=CC=CC=C2)C

Isomeric SMILES

CCC[C@H]1CC(=C(C([C@@H]1C=O)(C)C)COCC2=CC=CC=C2)C

InChI

InChI=1S/C21H30O2/c1-5-9-18-12-16(2)20(21(3,4)19(18)13-22)15-23-14-17-10-7-6-8-11-17/h6-8,10-11,13,18-19H,5,9,12,14-15H2,1-4H3/t18-,19+/m0/s1