(1R,4R,5S)-1-methyl-4-propan-2-yl-bicyclo[2.2.2]oct-2-ene-5-carbaldehyde

Systemtic Name: (1R,4R,5S)-1-methyl-4-propan-2-yl-bicyclo[2.2.2]oct-2-ene-5-carbaldehyde Openeye Name: (1R,4R,5S)-4-isopropyl-1-methyl-bicyclo[2.2.2]oct-2-ene-5-carbaldehyde CAS Name: (1R,4R,5S)-1-methyl-4-propan-2-yl-5-bicyclo[2.2.2]oct-2-enecarboxaldehyde IUPAC Name: (1R,4R,5S)-1-methyl-4-propan-2-ylbicyclo[2.2.2]oct-2-ene-5-carbaldehyde Traditional Name: (1R,4R,5S)-4-isopropyl-1-methyl-bicyclo[2.2.2]oct-2-ene-5-carbaldehyde Formula: C13H20O MolecularWeight: 192.2973

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C12CCC(CC1C=O)(C=C2)C

Isomeric SMILES

CC(C)[C@@]12CC[C@](C[C@@H]1C=O)(C=C2)C

InChI

InChI=1S/C13H20O/c1-10(2)13-6-4-12(3,5-7-13)8-11(13)9-14/h4,6,9-11H,5,7-8H2,1-3H3/t11-,12-,13-/m1/s1