2-[(3E,7E,11E)-4,8,12-trimethyl-13-oxidanyl-cyclotetradeca-3,7,11-trien-1-yl]prop-2-enal

Systemtic Name: 2-[(3E,7E,11E)-4,8,12-trimethyl-13-oxidanyl-cyclotetradeca-3,7,11-trien-1-yl]prop-2-enal Openeye Name: 2-[(3E,7E,11E)-13-hydroxy-4,8,12-trimethyl-cyclotetradeca-3,7,11-trien-1-yl]prop-2-enal CAS Name: 2-[(3E,7E,11E)-13-hydroxy-4,8,12-trimethyl-1-cyclotetradeca-3,7,11-trienyl]-2-propenal IUPAC Name: 2-[(3E,7E,11E)-13-hydroxy-4,8,12-trimethylcyclotetradeca-3,7,11-trien-1-yl]prop-2-enal Traditional Name: 2-[(3E,7E,11E)-13-hydroxy-4,8,12-trimethyl-cyclotetradeca-3,7,11-trien-1-yl]acrolein Formula: C20H30O2 MolecularWeight: 302.451

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCCC(=CCC(CC(C(=CCC1)C)O)C(=C)C=O)C

Isomeric SMILES

C/C/1=C\CC/C(=C/CC(CC(/C(=C/CC1)/C)O)C(=C)C=O)/C

InChI

InChI=1S/C20H30O2/c1-15-7-5-8-16(2)11-12-19(18(4)14-21)13-20(22)17(3)10-6-9-15/h7,10-11,14,19-20,22H,4-6,8-9,12-13H2,1-3H3/b15-7+,16-11+,17-10+