5-methyl-2-(6-oxidanylheptyl)-2-[(E)-3-oxidanylideneoct-1-enyl]cyclopentan-1-one

Systemtic Name: 5-methyl-2-(6-oxidanylheptyl)-2-[(E)-3-oxidanylideneoct-1-enyl]cyclopentan-1-one Openeye Name: 2-(6-hydroxyheptyl)-5-methyl-2-[(E)-3-oxooct-1-enyl]cyclopentanone CAS Name: 2-(6-hydroxyheptyl)-5-methyl-2-[(E)-3-oxooct-1-enyl]-1-cyclopentanone IUPAC Name: 2-(6-hydroxyheptyl)-5-methyl-2-[(E)-3-oxooct-1-enyl]cyclopentan-1-one Traditional Name: 2-(6-hydroxyheptyl)-2-[(E)-3-ketooct-1-enyl]-5-methyl-cyclopentanone Formula: C21H36O3 MolecularWeight: 336.50874

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)C=CC1(CCC(C1=O)C)CCCCCC(C)O

Isomeric SMILES

CCCCCC(=O)/C=C/C1(CCC(C1=O)C)CCCCCC(C)O

InChI

InChI=1S/C21H36O3/c1-4-5-7-11-19(23)13-16-21(15-12-17(2)20(21)24)14-9-6-8-10-18(3)22/h13,16-18,22H,4-12,14-15H2,1-3H3/b16-13+